From 49ddc9a3ba73878b8b8381392997f2717ea5662f Mon Sep 17 00:00:00 2001 From: Hermann Fuchs Date: Thu, 1 Oct 2026 12:07:39 +0200 Subject: [PATCH 1/4] Added the AMDM actor as described in Parisi et al 10.1002/acm2.14049 --- core/opengate_core/opengate_core.cpp | 2 + .../opengate_lib/GateAMDMActor.cpp | 132 + .../opengate_lib/GateAMDMActor.h | 43 + .../GateAMDMActor_lookUpTable.cpp | 94 + .../opengate_lib/GateAMDMActor_lookUpTable.hh | 22 + .../opengate_lib/pyGateAMDMActor.cpp | 32 + .../user_guide/user_guide_amdm_actor.rst | 302 ++ .../user_guide_reference_actors.rst | 5 + opengate/actors/amdmoutput.py | 83 + opengate/actors/doseactors.py | 172 + opengate/managers.py | 2 + .../actors/fixtures/test110_amdm/AMDM_LUT.txt | 4001 +++++++++++++++++ .../actors/fixtures/test110_amdm/README.md | 13 + .../tests/src/actors/test110_amdm_helpers.py | 196 + opengate/tests/src/actors/test110_amdm_lut.py | 73 + .../src/actors/test110_amdm_multiple_runs.py | 64 + .../tests/src/actors/test110_amdm_scoring.py | 99 + .../src/actors/test110_amdm_supplied_lut.py | 73 + .../tests/src/actors/test110_amdm_threads.py | 20 + simulation.json | 573 +++ 20 files changed, 6001 insertions(+) create mode 100644 core/opengate_core/opengate_lib/GateAMDMActor.cpp create mode 100644 core/opengate_core/opengate_lib/GateAMDMActor.h create mode 100644 core/opengate_core/opengate_lib/GateAMDMActor_lookUpTable.cpp create mode 100644 core/opengate_core/opengate_lib/GateAMDMActor_lookUpTable.hh create mode 100644 core/opengate_core/opengate_lib/pyGateAMDMActor.cpp create mode 100644 docs/source/user_guide/user_guide_amdm_actor.rst create mode 100644 opengate/actors/amdmoutput.py create mode 100644 opengate/tests/src/actors/fixtures/test110_amdm/AMDM_LUT.txt create mode 100644 opengate/tests/src/actors/fixtures/test110_amdm/README.md create mode 100644 opengate/tests/src/actors/test110_amdm_helpers.py create mode 100644 opengate/tests/src/actors/test110_amdm_lut.py create mode 100644 opengate/tests/src/actors/test110_amdm_multiple_runs.py create mode 100644 opengate/tests/src/actors/test110_amdm_scoring.py create mode 100644 opengate/tests/src/actors/test110_amdm_supplied_lut.py create mode 100644 opengate/tests/src/actors/test110_amdm_threads.py create mode 100644 simulation.json diff --git a/core/opengate_core/opengate_core.cpp b/core/opengate_core/opengate_core.cpp index e317eedc17..b1c7693bae 100644 --- a/core/opengate_core/opengate_core.cpp +++ b/core/opengate_core/opengate_core.cpp @@ -412,6 +412,7 @@ void init_GateVoxelizedPromptGammaAnalogActor(py::module &m); void init_GateFluenceActor(py::module &m); void init_GateLETActor(py::module &m); +void init_GateAMDMActor(py::module &m); void init_GateProductionAndStoppingActor(py::module &m); @@ -823,6 +824,7 @@ PYBIND11_MODULE(opengate_core, m) { init_GateVoxelizedPromptGammaAnalogActor(m); init_GateFluenceActor(m); init_GateLETActor(m); + init_GateAMDMActor(m); init_GateProductionAndStoppingActor(m); init_GateBeamQualityActor(m); init_GateEmCalculatorActor(m); diff --git a/core/opengate_core/opengate_lib/GateAMDMActor.cpp b/core/opengate_core/opengate_lib/GateAMDMActor.cpp new file mode 100644 index 0000000000..205b9ccafb --- /dev/null +++ b/core/opengate_core/opengate_lib/GateAMDMActor.cpp @@ -0,0 +1,132 @@ +/* -------------------------------------------------- + Copyright (C): OpenGATE Collaboration + LGPL, see LICENSE.md. + Original AMDM implementation: Hermann Fuchs, April 2025. + -------------------------------------------------- */ +#include "GateAMDMActor.h" +#include "GateHelpersDict.h" +#include "GateHelpersGeometry.h" +#include "GateHelpersImage.h" +#include +#include +#include +#include + +GateAMDMActor::GateAMDMActor(py::dict &user_info) : GateVActor(user_info, true) {} + +void GateAMDMActor::InitializeUserInfo(py::dict &user_info) { + GateVActor::InitializeUserInfo(user_info); + fBins = DictGetInt(user_info, "AMDM_Bins"); + fHitType = DictGetStr(user_info, "hit_type"); + if (fHitType != "random" && fHitType != "pre" && fHitType != "post" && + fHitType != "middle") + throw std::invalid_argument("AMDM hit_type must be random, pre, post or middle"); + fTranslation = DictGetG4ThreeVector(user_info, "translation"); + fRotation = DictGetG4RotationMatrix(user_info, "rotation"); + fTable.Read(DictGetStr(user_info, "LUTfilename"), fBins); +} + +void GateAMDMActor::InitializeCpp() { + GateVActor::InitializeCpp(); + cpp_amdm_restricted_edep_image = ImageType::New(); + cpp_amdm_delta_image = ImageType4D::New(); + cpp_amdm_gamma_image = ImageType4D::New(); +} + +void GateAMDMActor::BeginOfRunActionMasterThread(int) { + NbOfEvent = 0; + // Python supplies fresh zero-filled raw buffers for each run. Only attach the + // 3D domain: the generic attachment helper initializes only three axes. + G4ThreeVector volumeTranslation; + G4RotationMatrix volumeRotation; + ComputeTransformationFromVolumeToWorld(fPhysicalVolumeName, volumeTranslation, + volumeRotation, true); + G4ThreeVector center; + const auto size = cpp_amdm_restricted_edep_image->GetLargestPossibleRegion().GetSize(); + const auto spacing = cpp_amdm_restricted_edep_image->GetSpacing(); + for (unsigned int i = 0; i < 3; ++i) + center[i] = -(size[i] - 1.0) * spacing[i] / 2.0; + const auto spatialOrigin = volumeTranslation + + volumeRotation * (fRotation * center + fTranslation); + const auto spatialRotation = volumeRotation * fRotation; + ImageType::PointType origin3; + ImageType::DirectionType direction3; + for (unsigned int i = 0; i < 3; ++i) { + origin3[i] = spatialOrigin[i]; + for (unsigned int j = 0; j < 3; ++j) + direction3[i][j] = spatialRotation(i, j); + } + cpp_amdm_restricted_edep_image->SetOrigin(origin3); + cpp_amdm_restricted_edep_image->SetDirection(direction3); + ImageType4D::PointType origin; + ImageType4D::DirectionType direction; + direction.SetIdentity(); + origin.Fill(0); + for (unsigned int i = 0; i < 3; ++i) { + origin[i] = cpp_amdm_restricted_edep_image->GetOrigin()[i]; + for (unsigned int j = 0; j < 3; ++j) + direction[i][j] = cpp_amdm_restricted_edep_image->GetDirection()[i][j]; + } + for (auto image : {cpp_amdm_delta_image, cpp_amdm_gamma_image}) { + image->SetOrigin(origin); + image->SetDirection(direction); + } +} + +void GateAMDMActor::BeginOfEventAction(const G4Event *) { + std::lock_guard lock(fScoringMutex); + ++NbOfEvent; +} + +std::vector GateAMDMActor::Lookup(int charge, double energy) const { + std::vector values; + fTable.Find(charge, energy, values); + return values; // empty means this charge/sample does not contribute +} + +void GateAMDMActor::SteppingAction(G4Step *step) { + const auto pre = step->GetPreStepPoint()->GetPosition(); + const auto post = step->GetPostStepPoint()->GetPosition(); + auto position = post; + if (fHitType == "pre") + position = pre; + else if (fHitType == "middle") + position = pre + 0.5 * (post - pre); + else if (fHitType == "random") + position = pre + G4UniformRand() * (post - pre); + // As in DoseActor, the attached image domain is in world coordinates. + ImageType::PointType point; + for (unsigned int i = 0; i < 3; ++i) + point[i] = position[i]; + ImageType::IndexType index; + if (!cpp_amdm_restricted_edep_image->TransformPhysicalPointToIndex(point, index)) + return; + const auto *track = step->GetTrack(); + const int charge = static_cast(track->GetDefinition()->GetPDGCharge()); + if (charge <= 0) + return; + const int mass = track->GetDefinition()->GetBaryonNumber(); + const double kineticEnergy = track->GetKineticEnergy() / CLHEP::MeV; + // Preserve legacy applicability, including its zero-baryon rule: positive + // energy / 0 samples the upper endpoint; 0 / 0 contributes nothing. + const double energy = mass == 0 + ? (kineticEnergy > 0 ? std::numeric_limits::infinity() + : std::numeric_limits::quiet_NaN()) + : kineticEnergy / mass; + auto values = Lookup(charge, energy); + if (values.empty()) + return; + const double edep = step->GetTotalEnergyDeposit() / CLHEP::MeV * track->GetWeight(); + ImageType4D::IndexType index4; + for (unsigned int i = 0; i < 3; ++i) + index4[i] = index[i]; + // One actor-owned lock protects all shared accumulator updates. + std::lock_guard lock(fScoringMutex); + ImageAddValue(cpp_amdm_restricted_edep_image, index, edep); + for (int b = 0; b < fBins; ++b) { + index4[3] = b; + const double delta = values[fBins + b] * edep; + ImageAddValue(cpp_amdm_delta_image, index4, delta); + ImageAddValue(cpp_amdm_gamma_image, index4, values[b] * delta); + } +} diff --git a/core/opengate_core/opengate_lib/GateAMDMActor.h b/core/opengate_core/opengate_lib/GateAMDMActor.h new file mode 100644 index 0000000000..36a04eacda --- /dev/null +++ b/core/opengate_core/opengate_lib/GateAMDMActor.h @@ -0,0 +1,43 @@ +/* -------------------------------------------------- + Copyright (C): OpenGATE Collaboration + LGPL, see LICENSE.md. + Original AMDM implementation: Hermann Fuchs, April 2025. + -------------------------------------------------- */ +#ifndef GateAMDMActor_h +#define GateAMDMActor_h + +#include "GateAMDMActor_lookUpTable.hh" +#include "GateVActor.h" +#include +#include +#include + +class GateAMDMActor : public GateVActor { +public: + using ImageType = itk::Image; + using ImageType4D = itk::Image; + explicit GateAMDMActor(py::dict &user_info); + void InitializeUserInfo(py::dict &user_info) override; + void InitializeCpp() override; + void BeginOfRunActionMasterThread(int run_id) override; + void BeginOfEventAction(const G4Event *) override; + void SteppingAction(G4Step *) override; + std::string GetPhysicalVolumeName() const { return fPhysicalVolumeName; } + void SetPhysicalVolumeName(std::string name) { fPhysicalVolumeName = name; } + std::vector Lookup(int charge, double energy) const; + + ImageType::Pointer cpp_amdm_restricted_edep_image; + ImageType4D::Pointer cpp_amdm_delta_image; // raw sums, never normalized in place + ImageType4D::Pointer cpp_amdm_gamma_image; + int NbOfEvent = 0; + +private: + GateAMDMLookUpTable fTable; + int fBins = 10; + std::string fHitType; + std::string fPhysicalVolumeName; + G4ThreeVector fTranslation; + G4RotationMatrix fRotation; + std::mutex fScoringMutex; // owned by this actor, shared by its workers +}; +#endif diff --git a/core/opengate_core/opengate_lib/GateAMDMActor_lookUpTable.cpp b/core/opengate_core/opengate_lib/GateAMDMActor_lookUpTable.cpp new file mode 100644 index 0000000000..0c0d063869 --- /dev/null +++ b/core/opengate_core/opengate_lib/GateAMDMActor_lookUpTable.cpp @@ -0,0 +1,94 @@ +/* Copyright (C): OpenGATE Collaboration. See LICENSE.md for LGPL terms. */ +#include "GateAMDMActor_lookUpTable.hh" +#include +#include +#include +#include +#include +#include + +void GateAMDMLookUpTable::Read(const std::string &filename, int bins) { + if (bins <= 0 || bins > (std::numeric_limits::max() - 2) / 2) + throw std::invalid_argument("AMDM_Bins must be a positive integer"); + std::ifstream input(filename); + if (!input) + throw std::invalid_argument("AMDM cannot open LUT: " + filename); + std::map> data; + std::string line; + int previousCharge = 0; + size_t lineNumber = 0; + while (std::getline(input, line)) { + ++lineNumber; + line = line.substr(0, line.find('#')); + std::istringstream stream(line); + std::vector columns; + std::string token; + auto fail = [&](const std::string &reason) { + throw std::invalid_argument("AMDM LUT " + filename + ":" + + std::to_string(lineNumber) + ": " + reason); + }; + while (stream >> token) { + try { + size_t used; + double value = std::stod(token, &used); + if (used != token.size() || !std::isfinite(value)) + fail("entries must be finite numeric values"); + columns.push_back(value); + } catch (const std::exception &) { + fail("entries must be finite numeric values"); + } + } + if (columns.empty()) + continue; + if (columns.size() != static_cast(2 + 2 * bins)) + fail("column count must equal 2 + 2 * AMDM_Bins"); + double key = columns[0]; + if (key <= 0 || key > std::numeric_limits::max() || + std::floor(key) != key) + fail("charge must be a positive integer"); + int charge = static_cast(key); + if (charge < previousCharge) + fail("charge groups must be increasing"); + if (columns[1] <= 0) + fail("energy keys must be positive (MeV/n)"); + auto &group = data[charge]; + if (!group.empty() && columns[1] <= group.back().energy) + fail("energy keys must be unique and strictly increasing within a charge"); + group.push_back({columns[1], {columns.begin() + 2, columns.end()}}); + previousCharge = charge; + } + if (input.bad()) + throw std::invalid_argument("AMDM error reading LUT: " + filename); + if (data.empty()) + throw std::invalid_argument("AMDM LUT contains no data: " + filename); + fData = std::move(data); +} + +bool GateAMDMLookUpTable::Find(int charge, double energy, + std::vector &values) const { + values.clear(); + auto found = fData.find(charge); + if (found == fData.end() || std::isnan(energy)) + return false; + const auto &rows = found->second; + // Clamp before inspecting a lower_bound iterator, including the final charge. + if (energy <= rows.front().energy) { + values = rows.front().values; + } else if (energy >= rows.back().energy) { + values = rows.back().values; + } else { + auto upper = std::lower_bound( + rows.begin(), rows.end(), energy, + [](const Row &row, double value) { return row.energy < value; }); + if (upper->energy == energy) { + values = upper->values; + } else { + const auto &lower = *std::prev(upper); + const double fraction = (energy - lower.energy) / (upper->energy - lower.energy); + values.resize(lower.values.size()); + for (size_t b = 0; b < values.size(); ++b) + values[b] = lower.values[b] + fraction * (upper->values[b] - lower.values[b]); + } + } + return true; +} diff --git a/core/opengate_core/opengate_lib/GateAMDMActor_lookUpTable.hh b/core/opengate_core/opengate_lib/GateAMDMActor_lookUpTable.hh new file mode 100644 index 0000000000..b7a74e4fa7 --- /dev/null +++ b/core/opengate_core/opengate_lib/GateAMDMActor_lookUpTable.hh @@ -0,0 +1,22 @@ +/* Copyright (C): OpenGATE Collaboration. See LICENSE.md for LGPL terms. */ +#ifndef GateAMDMActor_lookUpTable_h +#define GateAMDMActor_lookUpTable_h + +#include +#include +#include + +// Immutable after loading. Each charge has its own energy grid and endpoints. +class GateAMDMLookUpTable { +public: + void Read(const std::string &filename, int bins); + bool Find(int charge, double energy, std::vector &values) const; + +private: + struct Row { + double energy; + std::vector values; // gamma bins, then delta bins + }; + std::map> fData; +}; +#endif diff --git a/core/opengate_core/opengate_lib/pyGateAMDMActor.cpp b/core/opengate_core/opengate_lib/pyGateAMDMActor.cpp new file mode 100644 index 0000000000..7fb2c859c8 --- /dev/null +++ b/core/opengate_core/opengate_lib/pyGateAMDMActor.cpp @@ -0,0 +1,32 @@ +/* Copyright (C): OpenGATE Collaboration. See LICENSE.md for LGPL terms. */ +#include "GateAMDMActor.h" +#include +#include + +class PyGateAMDMActor : public GateAMDMActor { +public: + using GateAMDMActor::GateAMDMActor; + void BeginOfRunActionMasterThread(int run_id) override { + PYBIND11_OVERLOAD(void, GateAMDMActor, BeginOfRunActionMasterThread, run_id); + } + int EndOfRunActionMasterThread(int run_id) override { + PYBIND11_OVERLOAD(int, GateAMDMActor, EndOfRunActionMasterThread, run_id); + } +}; + +void init_GateAMDMActor(py::module &m) { + py::class_, GateVActor>( + m, "GateAMDMActor") + .def(py::init()) + .def("BeginOfRunActionMasterThread", &GateAMDMActor::BeginOfRunActionMasterThread) + .def("EndOfRunActionMasterThread", &GateAMDMActor::EndOfRunActionMasterThread) + .def_readwrite("cpp_amdm_restricted_edep_image", + &GateAMDMActor::cpp_amdm_restricted_edep_image) + .def_readwrite("cpp_amdm_delta_image", &GateAMDMActor::cpp_amdm_delta_image) + .def_readwrite("cpp_amdm_gamma_image", &GateAMDMActor::cpp_amdm_gamma_image) + .def_readonly("NbOfEvent", &GateAMDMActor::NbOfEvent) + .def("Lookup", &GateAMDMActor::Lookup, py::arg("charge"), py::arg("energy")) + .def("GetPhysicalVolumeName", &GateAMDMActor::GetPhysicalVolumeName) + .def("SetPhysicalVolumeName", &GateAMDMActor::SetPhysicalVolumeName); +} diff --git a/docs/source/user_guide/user_guide_amdm_actor.rst b/docs/source/user_guide/user_guide_amdm_actor.rst new file mode 100644 index 0000000000..7a5e0eeeb1 --- /dev/null +++ b/docs/source/user_guide/user_guide_amdm_actor.rst @@ -0,0 +1,302 @@ +.. _amdm-actor-label: + +AMDMActor +========= + +``AMDMActor`` scores energy-weighted AMDM delta and gamma values on a voxel +grid. Gamma (also called yd in the table) is expressed in keV/µm; delta is +dimensionless. The actor uses the material and particle transport of the +simulation without changing the physics model. + +Discussion +---------- + +The abridged microdosimetric distribution methodology (AMDM) was published by +Parisi, Beltran and Furutani in `10.1002/acm2.14049 +`_. It was subsequently used in OpenGATE10 +by Fuchs et al. to study the influence of carbon-ion nozzle configurations on +microdosimetric spectra and RBE in `10.1016/j.zemedi.2025.04.004 +`_. + +AMDM is intended to retain compact summaries of the microdosimetric spectra +in each voxel for carbon-ion transport studies and subsequent RBE calculations. +Storing bin-wise dose fractions and dose-mean lineal energies allows later +evaluation with a microdosimetric model, such as the Mayo Clinic Florida +microdosimetric kinetic model (MCF MKM), using the chosen cell-line parameters. +The actor generates the physical quantities; the biological-model calculation +is performed separately. + +To use the generated data, read the paired normalized ``delta`` and ``gamma`` +images, either through ``amdm.delta.get_data()`` and ``amdm.gamma.get_data()`` +after the simulation or from their MetaImage files with ITK. For each voxel, +delta gives the dose fraction in each LUT bin and gamma gives its dose-mean +lineal energy in keV/µm. Keep the voxel geometry and LUT bin definitions with +the images when passing these values to a microdosimetric model. When combining +independent simulations, sum restricted energy, raw delta and raw gamma before +normalizing; enable ``storeMergingData`` to save those raw sums. + +Example +------- + +Supply a LUT appropriate to the particles, energy range and microdosimetric bin +definitions of your study, and set ``LUTfilename`` to its location. A production +LUT is not bundled at the repository root or automatically installed there. +The development table is retained separately as a test fixture. + +.. code-block:: python + + import opengate as gate + + sim = gate.Simulation() + sim.output_dir = "output" + sim.world.size = [100, 100, 100] + sim.world.material = "G4_WATER" + sim.physics_manager.physics_list_name = "G4EmStandardPhysics_option3" + source = sim.add_source("GenericSource", "carbon") + source.particle = "ion 6 12" + source.energy.mono = 60 * gate.g4_units.MeV + source.number_of_primaries = 100 + source.position.type = "point" + source.direction.type = "momentum" + source.direction.momentum = [0, 0, 1] + amdm = sim.add_actor("AMDMActor", "amdm") + amdm.attached_to = "world" + amdm.LUTfilename = "/path/to/your/AMDM_LUT.txt" + amdm.AMDM_Bins = 10 + amdm.size = [5, 5, 5] + amdm.spacing = [10 * gate.g4_units.mm] * 3 + amdm.output_filename = "amdm.mhd" + amdm.storeMergingData = True + amdm.user_output.amdm.keep_data_per_run = True + sim.run() + delta = amdm.delta.get_data() # merged normalized 4D image + gamma = amdm.gamma.get_data() # merged normalized 4D image + restricted = amdm.restrictedEdep.get_data() # merged weighted MeV, 3D + +Configuration +------------- + +All lengths use OpenGATE internal units (mm) and can be specified by +multiplication with ``gate.g4_units``. Rotations and voxel/bin counts are +unitless. The three spatial components are ordered x, y, z. The AMDM parameters +retain their historical capitalization. + +.. list-table:: AMDM and inherited configuration + :header-rows: 1 + :widths: 20 22 58 + + * - Parameter + - Type and default + - Units, supported values and validation + * - ``name`` + - str, required + - Unique actor name supplied through ``sim.add_actor``. + * - ``LUTfilename`` + - str or pathlib.Path, ``"AMDM_LUT.txt"`` + - Nonempty readable table path, relative to the working directory or + absolute. Marked as an input file for archiving. Missing/malformed tables + raise an exception during initialization. The default is a relative + filename, not a bundled table; set this parameter to your own LUT path. + * - ``AMDM_Bins`` + - int, 10 + - Positive bin count, excluding booleans. Must match the exact column count + ``2 + 2 * AMDM_Bins``. Counts must fit the C++ integer range. + * - ``storeMergingData`` + - bool, False + - Activates the raw delta/gamma file interfaces. In-memory merging and + thread safety work with either value. Individual ``write_to_disk`` + controls still apply. + * - ``attached_to`` + - volume or str, ``"world"`` + - One existing volume only; a list of volumes is unsupported. Daughters + use the same scoring grid. The volume may move between runs. + * - ``size`` + - three integers, [10, 10, 10] + - Positive spatial voxel counts. ``"like_image_volume"`` uses an attached + ImageVolume's grid; incompatible volume types raise an exception. + * - ``spacing`` + - three numbers, [1, 1, 1] mm + - Finite positive spatial voxel sizes. ``"like_image_volume"`` uses the + attached image spacing. + * - ``translation`` + - three numbers, [0, 0, 0] mm + - Finite offset of the scoring-grid center in the attached volume frame. + * - ``rotation`` + - 3x3 matrix, identity + - Finite proper orthonormal rotation of the grid within the volume. + * - ``repeated_volume_index`` + - int, 0 + - Selects the attached physical volume when copies exist. The inherited + physical-volume lookup reports unavailable indices. + * - ``hit_type`` + - str, ``"random"`` + - ``"pre"``, ``"post"``, ``"middle"`` or ``"random"``. The latter samples + uniformly along the pre/post position segment, as in the source actor. + * - ``output_coordinate_system`` + - str or None, ``"local"`` + - ``"local"``: attached-volume coordinates; ``"global"``: world coordinates; + ``"attached_to_image"``: native attached ImageVolume coordinates; + None: centered image with identity direction. The image option requires + an ImageVolume. This changes output coordinates, not transport scoring. + * - ``filter`` + - filter object or None, None + - Current OpenGATE step filter; accepted steps alone are scored. + * - ``priority`` + - int, 100 + - Inherited callback ordering; lower values run earlier. + * - ``track_structure_em_physics`` + - str or None, None + - Inherited region-physics request. Supported values are the constructors + in ``Region.available_track_structure_em_physics``; requires one volume. + * - ``output``, ``img_coord_system``, ``mother``, ``filters`` + - deprecated, None + - Existing framework deprecation errors. Use ``output_filename``, + ``output_coordinate_system``, ``attached_to`` and ``filter`` respectively. + * - ``filters_boolean_operator`` + - deprecated, ``"and"`` + - Use the current filter-composition API. + +The output interfaces are ``restrictedEdep``, ``raw_delta``, ``raw_gamma``, +``delta`` and ``gamma``. Set ``amdm.output_filename`` to configure the shared +basename, or set an interface's ``output_filename`` (str or Path, default +``"auto"``) to configure its actual filename. The actor-wide getter returns the +configured delta filename. Filenames of the AMDM images use ``.mhd`` when the +actor-wide basename is set, regardless of the requested final extension. + +All interfaces support the current ``active`` and ``write_to_disk`` boolean +controls. Restricted energy and normalized images are active by default; +``storeMergingData`` controls activation of the two raw interfaces during +initialization. Writing defaults to True on all interfaces; inactive raw +interfaces produce no files. ``amdm.write_to_disk = False`` suppresses all image +writes, including raw files with ``storeMergingData=True``. Disabling an output +interface does not remove raw denominators needed by the other outputs. + +The shared output ``amdm.user_output.amdm`` supports +``keep_data_per_run`` (bool, False), ``merge_data_after_simulation`` (bool, True) +and ``keep_data_in_memory`` (bool, True). Set ``keep_data_per_run=True`` to retain +and write separately indexed runs. With merging disabled, enable per-run data +retention to keep results. Set ``keep_data_in_memory=False`` to release the +outputs at simulation close; use the files thereafter. Set output filenames to +None or an empty string only with the corresponding disk writes disabled. + +Lookup and scoring +------------------ + +The LUT has two key columns (positive integral charge and positive energy in +MeV/n), then one gamma/yd column per bin in keV/µm, then one dimensionless delta +column per bin. All entries must be finite numbers. Charge groups must be +ordered; energy keys must be unique and strictly increasing within each group. +Groups may have different sizes and energy ranges, including a single entry. +Blank lines, whitespace, and comments starting with ``#`` are accepted. +Validation checks the schema; it does not require a particular gamma/delta +model or force the delta values to sum to one. + +Bin values interpolate linearly in energy within the particle's charge group. +Values below/above its energy range clamp to that group's first/last row. +Missing charges contribute neither to the restricted energy nor to the bins. + +For compatibility with the source actor, the LUT query uses the track's kinetic +energy at the scoring callback (post-step energy), divided by its baryon number. +It does not use mean pre/post energy. Track weight multiplies the deposited +energy in MeV. Only strictly positive integer-converted PDG charges contribute. +The source's unusual zero-baryon behavior is retained explicitly: a positive +kinetic energy with zero baryon number samples that charge's upper endpoint; +zero kinetic energy with zero baryon number contributes nothing. Thus positive +ions are the intended use, but positive-charge zero-baryon particles are not +silently removed as a scientific-model change. + +For each accepted step and bin b, with weighted deposit e: + +.. code-block:: text + + restrictedEdep += e + raw_delta[b] += delta_LUT[b] * e + raw_gamma[b] += gamma_LUT[b] * delta_LUT[b] * e + delta[b] = raw_delta[b] / restrictedEdep + gamma[b] = raw_gamma[b] / raw_delta[b] + +The result is zero wherever the corresponding denominator is zero, including +empty voxels and zero-weight bins. Raw sums are never normalized in place. +Per-run and merged normalized images are views derived from raw sums; +normalized run images are never averaged directly. In-memory merging through +``merge_data_from_actor_output`` retains this rule. + +Threads share read-only lookup data and use an actor-owned mutex for accumulator +and event-count updates. Run initialization, image copying, normalization and +writing occur on the master after the appropriate worker boundaries. Both +single-thread and multithread execution are supported. The coarse lock favors +correctness and minimal changes; throughput scaling depends on scoring load. + +Coordinates and files +--------------------- + +The spatial origin uses the center of the first voxel, with its half-voxel +shift, translation and rotation. Geometry attachment is recomputed each run. +The fourth axis is the LUT bin axis, with spacing 1, origin 0 and independent +identity direction. Bin order follows the columns of the LUT. ITK/NumPy arrays +are ordered [bin, z, y, x]; the MetaImage size is [x, y, z, bin]. + +For ``amdm.output_filename = "result.mhd"``, filenames relative to +``sim.output_dir`` are: + +.. list-table:: Image outputs + :header-rows: 1 + + * - Filename + - Scalar type / dimension + - Quantity and units + * - ``result-delta.mhd`` + - double / 4D + - Normalized delta, dimensionless + * - ``result-gamma.mhd`` + - double / 4D + - Normalized gamma, keV/µm + * - ``result-restrictedEdep.mhd`` + - double / 3D + - Restricted weighted deposited energy, MeV + * - ``result-unprocessedForMergingOnly-delta.mhd`` + - double / 4D + - Raw delta numerator, MeV (dimensionless delta and weight) + * - ``result-unprocessedForMergingOnly-gamma.mhd`` + - double / 4D + - Raw gamma numerator, MeV·keV/µm + +Each ``.mhd`` references its binary payload, normally the corresponding +``.raw``. Preserve both files. The framework also writes +``-samples.mhd.json`` with the number of events; units are documented +here rather than represented as standard MetaImage fields. Per-run filenames +append ``-run0``, ``-run1``, etc. immediately before ``.mhd``. These run suffixes +and sample sidecars follow the current framework. The four legacy 4D basename +patterns and double scalar representation are preserved. Restricted energy now +has an explicitly resolved filename; the old wrapper's fluence callback did +not provide a functioning legacy output path. + +For moving geometry, outputs are merged by voxel index in the grid attached to +the volume, following current actor conventions. A merged global image has the +first contributing run's coordinates; it is not a resampling of all runs into a +fixed world grid. Retain per-run outputs to inspect their individual poses. + +Validation and migration +------------------------ + +Use ``sim.add_actor("AMDMActor", "amdm")`` and ``attached_to``. Replace obsolete +``output`` with ``output_filename`` and ``sim.output_dir``. Initialization and +callbacks use the current framework; wrong fluence references, duplicate LUT +allocation, unchecked endpoint iterators, process-exit errors and destructive +normalization were repaired. Zero denominators now explicitly yield zero. + +Tests in ``tests/src/actors/test110_amdm_*.py`` exercise independently known +constant-bin results, interpolation and malformed tables, full output headers +and payloads, zero bins, coordinates, track weights, unequal run contributions, +raw-first merging and single/multithread aggregates. The supplied-LUT test uses +the development fixture ``tests/src/actors/fixtures/test110_amdm/AMDM_LUT.txt`` +with SHA-256 +``93d42113b9f48e3ec069000f5983e4568f7bca2e873d1cb06186d08f949771ab``; +it compares the ten raw bins to independently recorded PhaseSpaceActor steps +and NumPy interpolation. This is analytical/transport-step acceptance evidence. +No independently trusted legacy output image was found for a legacy numerical +comparison. The fixture is a test input, not a generated output reference or a +production LUT selected automatically by the actor. The original root-level +development file is not required to run the tests. + +.. autoclass:: opengate.actors.doseactors.AMDMActor diff --git a/docs/source/user_guide/user_guide_reference_actors.rst b/docs/source/user_guide/user_guide_reference_actors.rst index 9ab54ea53a..ebbbac4ef7 100644 --- a/docs/source/user_guide/user_guide_reference_actors.rst +++ b/docs/source/user_guide/user_guide_reference_actors.rst @@ -8,6 +8,11 @@ Details: Actors Overview: Types of actors ------------------------- +.. toctree:: + :maxdepth: 1 + + user_guide_amdm_actor + Hits-related actors (digitizers) ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ diff --git a/opengate/actors/amdmoutput.py b/opengate/actors/amdmoutput.py new file mode 100644 index 0000000000..7ad7e2b691 --- /dev/null +++ b/opengate/actors/amdmoutput.py @@ -0,0 +1,83 @@ +"""AMDM raw accumulators and derived images, using the actor-output lifecycle.""" + +from pathlib import Path + +import itk +import numpy as np + +from ..base import process_cls +from .actoroutput import ActorOutputImage +from .dataitems import ( + DataItemContainer, + ImageDataItemContainerMixin, + ItkImageDataItem, + derived_data_item, + _process_data_item_container_class, +) + + +class AMDMImageContainer(ImageDataItemContainerMixin, DataItemContainer): + # Persist and merge only raw sums. Derived views never mutate those sums. + _data_item_classes = (ItkImageDataItem,) * 3 + primary_item_identifiers = (0, 1, 2) # restricted MeV, raw delta, raw gamma + + def _ratio(self, numerator, denominator): + n = self.data[numerator] + d = self.data[denominator] + if n.data_is_none or d.data_is_none: + return ItkImageDataItem(data=None) + na = itk.array_view_from_image(n.data) + da = itk.array_view_from_image(d.data) + result = np.zeros_like(na) + np.divide(na, da, out=result, where=da != 0) + image = itk.image_from_array(result, is_vector=False) + image.CopyInformation(n.data) + item = ItkImageDataItem(data=image) + item.number_of_samples = n.number_of_samples + return item + + @derived_data_item(depends_on=(0, 1)) + def delta(self): + return self._ratio(1, 0) + + @derived_data_item(depends_on=(1, 2)) + def gamma(self): + return self._ratio(2, 1) + + def set_image_properties(self, item="all", **properties): + # VoxelDepositActor supplies spatial properties. Keep the bin axis + # independent when applying them to the two four-dimensional buffers. + for image_item in self._get_image_data_items(item): + p = dict(properties) + if not image_item.data_is_none and image_item.data.GetImageDimension() == 4: + for key, final in (("origin", 0.0), ("spacing", 1.0)): + if p.get(key) is not None and len(p[key]) == 3: + p[key] = list(p[key]) + [final] + image_item.set_image_properties(**p) + + +_process_data_item_container_class(AMDMImageContainer) + + +class ActorOutputAMDM(ActorOutputImage): + """Raw-first merge semantics with the legacy AMDM MetaImage filenames.""" + + data_container_class = AMDMImageContainer + _suffixes = { + 0: "restrictedEdep", + 1: "unprocessedForMergingOnly-delta", + 2: "unprocessedForMergingOnly-gamma", + "delta": "delta", + "gamma": "gamma", + } + + def _insert_item_suffix(self, output_filename, item): + if output_filename in (None, "", "auto"): + return output_filename + path = Path(output_filename) + # The legacy contract removes the final extension, including .gz only + # for a basename ending in .nii.gz. AMDM image outputs are always .mhd. + return str(path.with_name(f"{path.stem}-{self._suffixes[item]}.mhd")) + + +process_cls(ActorOutputAMDM) diff --git a/opengate/actors/doseactors.py b/opengate/actors/doseactors.py index d199ecbd93..660c23e0fc 100644 --- a/opengate/actors/doseactors.py +++ b/opengate/actors/doseactors.py @@ -6,6 +6,7 @@ import opengate_core as g4 from .base import ActorBase +from .amdmoutput import ActorOutputAMDM from ..exception import fatal from ..utility import g4_units from ..image import ( @@ -2210,6 +2211,177 @@ def initialize(self, *args): self.InitializeCpp() +class AMDMActor(VoxelDepositActor, g4.GateAMDMActor): + """Score AMDM bin-wise delta and gamma using a charge/energy LUT. + + Raw sums are merged before normalization. The bin axis has unit spacing + and zero origin. Delta is dimensionless and gamma is in keV/µm. + """ + + user_info_defaults = { + "LUTfilename": ( + "AMDM_LUT.txt", + { + "doc": "AMDM LUT path, with energy in MeV/n and gamma in keV/µm.", + "is_input_file": True, + }, + ), + "AMDM_Bins": ( + 10, + {"doc": "Positive integer bin count; LUT must have 2 + 2*AMDM_Bins columns."}, + ), + "storeMergingData": ( + False, + { + "doc": "Write the raw delta and gamma sums for external merging.", + "allowed_values": (True, False), + }, + ), + } + + user_output_config = { + "amdm": { + "actor_output_class": ActorOutputAMDM, + "interfaces": { + "restrictedEdep": { + "interface_class": UserInterfaceToActorOutputImage, + "item": 0, + "active": True, + "write_to_disk": True, + }, + "raw_delta": { + "interface_class": UserInterfaceToActorOutputImage, + "item": 1, + "active": False, + "write_to_disk": True, + }, + "raw_gamma": { + "interface_class": UserInterfaceToActorOutputImage, + "item": 2, + "active": False, + "write_to_disk": True, + }, + "delta": { + "interface_class": UserInterfaceToActorOutputImage, + "item": "delta", + "active": True, + "write_to_disk": True, + }, + "gamma": { + "interface_class": UserInterfaceToActorOutputImage, + "item": "gamma", + "active": True, + "write_to_disk": True, + }, + }, + }, + } + + def __init__(self, *args, **kwargs): + VoxelDepositActor.__init__(self, *args, **kwargs) + self.__initcpp__() + + def __initcpp__(self): + g4.GateAMDMActor.__init__(self, self.user_info) + self.AddActions( + { + "StartSimulationAction", + "EndSimulationAction", + "BeginOfRunActionMasterThread", + "EndOfRunActionMasterThread", + "BeginOfEventAction", + "SteppingAction", + } + ) + + @property + def output_filename(self): + return self.delta.output_filename + + @output_filename.setter + def output_filename(self, filename): + # Keep the legacy hyphenated names when setting the actor-wide basename. + self.user_output.amdm.set_output_filename(filename, item="all") + + def initialize(self): + VoxelDepositActor.initialize(self) + self.check_user_input() + if not isinstance(self.attached_to, str): + fatal("AMDMActor requires one attached_to volume") + if ( + isinstance(self.AMDM_Bins, (bool, np.bool_)) + or not isinstance(self.AMDM_Bins, (int, np.integer)) + or self.AMDM_Bins <= 0 + ): + fatal("AMDM_Bins must be a positive integer") + size = np.asarray(self.size) + if ( + size.shape != (3,) + or not np.all(np.isfinite(size)) + or np.any(size <= 0) + or np.any(size != np.floor(size)) + ): + fatal("AMDM size must contain three positive integers") + for name in ("spacing", "translation"): + value = np.asarray(getattr(self, name), dtype=float) + if value.shape != (3,) or not np.all(np.isfinite(value)) or ( + name == "spacing" and np.any(value <= 0) + ): + fatal( + f"AMDM {name} must contain three finite values" + + (" greater than zero" if name == "spacing" else "") + ) + rotation = np.asarray(self.rotation, dtype=float) + if rotation.shape != (3, 3) or not np.all(np.isfinite(rotation)) or not ( + np.allclose(rotation.T @ rotation, np.eye(3), atol=1e-10, rtol=0) + and np.isclose(np.linalg.det(rotation), 1, atol=1e-10, rtol=0) + ): + fatal("AMDM rotation must be a proper orthonormal 3x3 matrix") + if not isinstance(self.LUTfilename, (str, Path)) or not str(self.LUTfilename): + fatal("AMDM LUTfilename must be a nonempty file path") + self.LUTfilename = str(self.LUTfilename) + self.InitializeUserInfo(self.user_info) + self.InitializeCpp() + self.raw_delta.active = self.storeMergingData + self.raw_gamma.active = self.storeMergingData + + def BeginOfRunActionMasterThread(self, run_index): + from ..image import create_3d_image, create_4d_image + + images = [create_3d_image(self.size, self.spacing, pixel_type="double")] + for _ in range(2): + image = create_4d_image( + list(self.size) + [self.AMDM_Bins], list(self.spacing) + [1.0] + ) + image.FillBuffer(0.0) + images.append(image) + cpp_images = ( + self.cpp_amdm_restricted_edep_image, + self.cpp_amdm_delta_image, + self.cpp_amdm_gamma_image, + ) + for image, cpp_image in zip(images, cpp_images): + update_image_py_to_cpp(image, cpp_image, copy_data=True) + g4.GateAMDMActor.BeginOfRunActionMasterThread(self, run_index) + + def EndOfRunActionMasterThread(self, run_index): + self.user_output.amdm.store_data( + run_index, + *( + get_py_image_from_cpp_image(image, view=False) + for image in ( + self.cpp_amdm_restricted_edep_image, + self.cpp_amdm_delta_image, + self.cpp_amdm_gamma_image, + ) + ), + ) + self._update_output_coordinate_system("amdm", run_index) + self.user_output.amdm.set_number_of_samples(run_index, self.NbOfEvent) + return VoxelDepositActor.EndOfRunActionMasterThread(self, run_index) + + +process_cls(AMDMActor) process_cls(VoxelDepositActor) process_cls(DoseActor) process_cls(TLEDoseActor) diff --git a/opengate/managers.py b/opengate/managers.py index 3232ba197c..de8e185653 100644 --- a/opengate/managers.py +++ b/opengate/managers.py @@ -115,6 +115,7 @@ BeamQualityActor, DoseActor, EmCalculatorActor, + AMDMActor, FluenceActor, LETActor, ProductionAndStoppingActor, @@ -176,6 +177,7 @@ "REActor": REActor, "BeamQualityActor": BeamQualityActor, "EmCalculatorActor": EmCalculatorActor, + "AMDMActor": AMDMActor, "FluenceActor": FluenceActor, # misc "VoxelizedPromptGammaTLEActor": VoxelizedPromptGammaTLEActor, diff --git a/opengate/tests/src/actors/fixtures/test110_amdm/AMDM_LUT.txt b/opengate/tests/src/actors/fixtures/test110_amdm/AMDM_LUT.txt new file mode 100644 index 0000000000..d9e90cb170 --- /dev/null +++ b/opengate/tests/src/actors/fixtures/test110_amdm/AMDM_LUT.txt @@ -0,0 +1,4001 @@ +#charge E [MeV/n] yd bin1 [keV/µm] yd bin2 [keV/µm] yd bin3 [keV/µm] yd bin4 [keV/µm] yd bin5 [keV/µm] yd bin6 [keV/µm] yd bin7 [keV/µm] yd bin8 [keV/µm] yd bin9 [keV/µm] yd bin10 [keV/µm] delta bin1 delta bin2 delta bin3 delta bin4 delta bin5 delta bin6 delta bin7 delta bin8 delta bin9 delta bin10 +1 1 10.0838277129408 28.949130128874 44.446027704554 71.3557621997835 0 0 0 0 0 0 0.163558549024351 0.819295827460605 0.0171395231788995 6.10033614380629E-06 0 0 0 0 0 0 +1 1.01746 10.1200617652226 28.6905423377466 44.4572983722421 71.6383533445715 0 0 0 0 0 0 0.168222860509371 0.817112373285507 0.014657670459987 7.09574513478424E-06 0 0 0 0 0 0 +1 1.03523 10.1492246292466 28.4103141401371 44.4881331183093 71.9235190799081 102.355 0 0 0 0 0 0.174221081691939 0.813335603149792 0.0124337242000269 9.58381686509732E-06 7.14137724283883E-09 0 0 0 0 0 +1 1.05331 10.1786598528784 28.1314342101522 44.5383053466958 72.1593763729471 102.355 0 0 0 0 0 0.180283810015937 0.809091634838659 0.0106115639524154 1.2963736049738E-05 2.74569389551847E-08 0 0 0 0 0 +1 1.0717 10.2082767707758 27.8548708833261 44.6137529712705 72.3620264245328 103.716977344587 0 0 0 0 0 0.186412633607311 0.804441396987778 0.00912847166588258 1.74379625118879E-05 5.97765159486192E-08 0 0 0 0 0 +1 1.09042 10.2380417088021 27.5811884843892 44.7213025456301 72.5431071418227 103.956679228993 0 0 0 0 0 0.192615176186544 0.799430478195925 0.00793100006285277 2.32475391374534E-05 9.8015540719959E-08 0 0 0 0 0 +1 1.10946 10.2679740998666 27.3112047938512 44.8681127485919 72.712271467862 105.140865576662 0 0 0 0 0 0.198894216022684 0.794092287081485 0.00698259629060276 3.07283658275531E-05 1.72239400652256E-07 0 0 0 0 0 +1 1.12884 10.2979524032621 27.0454097214445 45.0598223350999 72.8716692357256 105.190100052191 0 0 0 0 0 0.205250857721983 0.788468333320838 0.00624039273527171 4.01603275189456E-05 2.55894388074716E-07 0 0 0 0 0 +1 1.14855 10.3279050402605 26.7845204805251 45.299461050351 73.023666441349 106.067855071054 0 0 0 0 0 0.211681579066844 0.782591198327917 0.00567494564386882 5.18772733205748E-05 3.99688049446836E-07 0 0 0 0 0 +1 1.16861 10.3578182889173 26.5287153277489 45.5859030824509 73.1702932424376 106.143505873541 0 0 0 0 0 0.218193359290974 0.776477612688248 0.00526218197226305 6.62727063734809E-05 5.73342141387429E-07 0 0 0 0 0 +1 1.18902 10.3876269100034 26.2784938453644 45.9128486279951 73.3130423434696 106.796295187925 0 0 0 0 0 0.224788635457982 0.770143313738796 0.00498341869382393 8.37940321220876E-05 8.38077275871591E-07 0 0 0 0 0 +1 1.20978 10.4174144072389 26.0342546238012 46.2690894596602 73.4535111515326 106.896469431164 0 0 0 0 0 0.231473525309232 0.763596424947677 0.00482390630248662 0.000104974423503889 1.16901710073773E-06 0 0 0 0 0 +1 1.23091 10.4470716331614 25.7961173211088 46.6401500265438 73.5910410106493 107.393459427962 0 0 0 0 0 0.238250407464796 0.756848777909315 0.00476888361803024 0.000130293504147814 1.6375037106306E-06 0 0 0 0 0 +1 1.2524 10.4765724885265 25.5644704110183 47.0105088497312 73.7255316070288 107.512569248052 0 0 0 0 0 0.24511763974432 0.749912820109426 0.00480708801019612 0.000160229343089421 2.22279296786797E-06 0 0 0 0 0 +1 1.27427 10.50590017325 25.3393826917539 47.3672582909952 73.8572617196697 107.899439600996 0 0 0 0 0 0.252080280874251 0.742791611394601 0.00492973259340746 0.000195367085608092 3.00805213253769E-06 0 0 0 0 0 +1 1.29653 10.5351071004926 25.1210507415117 47.7008349046627 73.9868933660466 108.033532900144 0 0 0 0 0 0.259148340489217 0.735480589635565 0.00513068444915302 0.000236397170200331 3.98825586456936E-06 0 0 0 0 0 +1 1.31917 10.5640942356967 24.9098174756286 48.0051174033722 74.1146048065269 108.347787206251 0 0 0 0 0 0.26632036710293 0.72798607782002 0.00540432868379558 0.000283966029692775 5.26036356201456E-06 0 0 0 0 0 +1 1.34221 10.5928697145974 24.7056831465841 48.2783236881489 74.2401777266104 108.49405523101 0 0 0 0 0 0.273602334822972 0.720306383857234 0.00574569263782508 0.000338755201045258 6.833480923694E-06 0 0 0 0 0 +1 1.36565 10.6214093985693 24.5088173958948 48.5208295523433 74.3633297779144 108.721032002562 0 0 0 0 0 0.280993004648916 0.7124468703735 0.00614997551049978 0.000401345417367255 8.80404971639606E-06 0 0 0 0 0 +1 1.3895 10.6496314110683 24.3193116739374 48.7348960772308 74.4840406586913 108.913022816179 0 0 0 0 0 0.288494753189896 0.704407630375538 0.00661395888044895 0.000472433123090431 1.12244310270408E-05 0 0 0 0 0 +1 1.41376 10.6776242199417 24.137382538484 48.923858112741 74.6028777914496 109.066277672663 0 0 0 0 0 0.296115671916493 0.696181322625477 0.00713594232370972 0.000552887234547853 1.41758997725583E-05 0 0 0 0 0 +1 1.43845 10.7052680015097 23.9630334847483 49.0912140543721 74.7197200083529 109.218522496439 154.925 0 0 0 0 0.303859057151751 0.687766443528836 0.00771327545873567 0.000643432537107719 1.77571060984045E-05 3.42174707543809E-08 0 0 0 0 +1 1.46357 10.7325982801073 23.7964778284889 49.2401840098125 74.8346543100625 109.370389425954 154.925 0 0 0 0 0.311725889268033 0.679162710003183 0.0083444048520189 0.000744875292012915 2.20738463774335E-05 4.67383741572908E-08 0 0 0 0 +1 1.48913 10.7595294491522 23.6377142881492 49.3734850960121 74.9473704775043 109.520828976799 157.291494856941 0 0 0 0 0.31971781389353 0.67037042197944 0.00902663380703531 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0 0 0 0 0 0.730286238152377 0.26971371147741 5.03702127720502E-08 0 0 0 0 0 0 0 +10 870.66207 7.10109759005726 19.3485805182815 43.2469248695542 0 0 0 0 0 0 0 0.735442930502551 0.264557020296253 4.92011964861853E-08 0 0 0 0 0 0 0 +10 885.86679 7.12717985770483 19.2942028556772 43.2529794189167 0 0 0 0 0 0 0 0.740569156501816 0.259430795198904 4.82992796433896E-08 0 0 0 0 0 0 0 +10 901.33704 7.15268359156462 19.2413860367022 43.2583544199458 0 0 0 0 0 0 0 0.745664157374515 0.254335795005387 4.76200973832566E-08 0 0 0 0 0 0 0 +10 917.07745 7.17757804830722 19.1900494665847 43.263097576891 0 0 0 0 0 0 0 0.750729938648677 0.249270014224489 4.71268341517457E-08 0 0 0 0 0 0 0 +10 933.09274 7.20190753974717 19.1401236584679 43.2672613257097 0 0 0 0 0 0 0 0.755767642009092 0.244232311202012 4.67888954404131E-08 0 0 0 0 0 0 0 +10 949.38772 7.22555563687723 19.0917294315863 43.2708934239724 0 0 0 0 0 0 0 0.760757277184016 0.239242676233839 4.6582144744374E-08 0 0 0 0 0 0 0 +10 965.96726 7.2485679870166 19.0447878975876 43.2740474311588 0 0 0 0 0 0 0 0.765704954195226 0.234294999319235 4.64855389957269E-08 0 0 0 0 0 0 0 +10 982.83633 7.27090298100282 18.9993047710049 43.2767726948011 0 0 0 0 0 0 0 0.770599812808272 0.229400140708904 4.64828234787994E-08 0 0 0 0 0 0 0 +10 1000 7.29251754423338 18.9552774022055 43.2791474943403 0 0 0 0 0 0 0 0.77543713224107 0.22456282120244 4.65564897171928E-08 0 0 0 0 0 0 0 diff --git a/opengate/tests/src/actors/fixtures/test110_amdm/README.md b/opengate/tests/src/actors/fixtures/test110_amdm/README.md new file mode 100644 index 0000000000..b59ee73235 --- /dev/null +++ b/opengate/tests/src/actors/fixtures/test110_amdm/README.md @@ -0,0 +1,13 @@ +# AMDM development LUT fixture + +`AMDM_LUT.txt` is a byte-for-byte copy of the development table supplied for +the AMDM port. Its SHA-256 is +`93d42113b9f48e3ec069000f5983e4568f7bca2e873d1cb06186d08f949771ab`. + +`test110_amdm_supplied_lut.py` loads this fixture relative to its own source +file, checks its checksum and schema, and compares scoring with independently +recorded transport steps. It does not need a LUT at the repository root. + +This is test input data, not an expected simulation output or a production LUT +selected automatically by AMDMActor. Users supply a table appropriate to their +study and explicitly configure `LUTfilename`. diff --git a/opengate/tests/src/actors/test110_amdm_helpers.py b/opengate/tests/src/actors/test110_amdm_helpers.py new file mode 100644 index 0000000000..3c8ba75c10 --- /dev/null +++ b/opengate/tests/src/actors/test110_amdm_helpers.py @@ -0,0 +1,196 @@ +"""Small AMDM test cases; all synthetic inputs and outputs stay under tests/output.""" + +from pathlib import Path +import json + +import itk +import numpy as np +import SimpleITK as sitk +from scipy.spatial.transform import Rotation + +import opengate as gate +from opengate.tests import utility + +GAMMA = np.array([2.0, 7.0, 13.0]) +DELTA = np.array([0.25, 0.75, 0.0]) + + +def output_dir(name): + paths = utility.get_default_test_paths(__file__) + path = paths.output / "test110_amdm" / name + path.mkdir(parents=True, exist_ok=True) + return path + + +def constant_lut(directory, entries=None): + if entries is None: + entries = {6: (GAMMA, DELTA)} + path = Path(directory) / "synthetic_lut.txt" + with path.open("w") as stream: + stream.write(" # charge energy[MeV/n] gamma[keV/um] delta\n\n") + for charge, (gamma, delta) in sorted(entries.items()): + for energy in [1.0, 10.0]: + stream.write(" ".join(map(str, [charge, energy, *gamma, *delta])) + "\n") + return path + + +def make_sim(directory, lut=None, threads=1, weight=1.0, hit_type="pre", + coordinate="local", particle="ion 6 12", primaries=80, + image_volume=False): + directory = Path(directory) + sim = gate.Simulation() + sim.output_dir = directory + sim.number_of_threads = threads + sim.random_seed = 9123456 + sim.g4_verbose = False + sim.visu = False + sim.world.size = [200, 200, 200] + sim.world.material = "G4_Galactic" + sim.physics_manager.physics_list_name = "G4EmStandardPhysics_option3" + sim.physics_manager.global_production_cuts.all = 1.0 + phantom = sim.add_volume("Image" if image_volume else "Box", "phantom") + if image_volume: + from opengate.image import create_3d_image + image = create_3d_image([5, 5, 5], [8, 8, 8], origin=[19, -11, 4]) + image.SetDirection(Rotation.from_euler("y", 15, degrees=True).as_matrix()) + image_path = directory / "volume.mhd" + itk.imwrite(image, str(image_path)) + phantom.image = str(image_path) + phantom.voxel_materials = [[-1, 1, "G4_WATER"]] + else: + phantom.size = [40, 40, 40] + phantom.material = "G4_WATER" + phantom.translation = [12.0, -8.0, 6.0] + phantom.rotation = Rotation.from_euler("z", 30, degrees=True).as_matrix() + actor = sim.add_actor("AMDMActor", "amdm") + actor.attached_to = phantom + actor.size = [5, 5, 5] + actor.spacing = [8, 8, 8] + actor.rotation = Rotation.from_euler("x", 20, degrees=True).as_matrix() + actor.translation = [2, 1, -1] + actor.hit_type = hit_type + actor.output_coordinate_system = coordinate + actor.LUTfilename = str(lut or constant_lut(directory)) + actor.AMDM_Bins = 3 + actor.storeMergingData = True + actor.output_filename = "result.mhd" + source = sim.add_source("GenericSource", "ions") + source.particle = particle + source.energy.mono = 60 * gate.g4_units.MeV + source.number_of_primaries = primaries + source.weight = weight + source.position.type = "point" + source.position.translation = (np.asarray(phantom.translation) + + phantom.rotation @ actor.translation).tolist() + source.direction.type = "momentum" + source.direction.momentum = (phantom.rotation @ actor.rotation @ [0, 0, 1]).tolist() + return sim, actor + + +def arrays(actor, which="merged"): + return tuple(itk.array_from_image(interface.get_data(which=which)) + for interface in (actor.restrictedEdep, actor.raw_delta, + actor.raw_gamma, actor.delta, actor.gamma)) + + +def expected_metadata(sim, actor): + center = -(np.asarray(actor.size) - 1) * np.asarray(actor.spacing) / 2 + origin = actor.rotation @ center + actor.translation + direction = actor.rotation + if actor.output_coordinate_system == "global": + volume = sim.volume_manager.get_volume("phantom") + origin = volume.rotation @ origin + volume.translation + direction = volume.rotation @ direction + elif actor.output_coordinate_system == "attached_to_image": + volume = actor.attached_to_volume + origin = volume.native_rotation @ origin + volume.native_translation + direction = volume.native_rotation @ direction + elif actor.output_coordinate_system is None: + origin = center + direction = np.eye(3) + return origin, direction + + +def check_image(path, dimension, actor, origin, direction, samples=None): + """Parse the header/payload independently with SimpleITK and compare to ITK.""" + path = Path(path) + assert path.is_file(), path + header = dict(line.split(" = ", 1) for line in path.read_text().splitlines() + if " = " in line) + assert int(header["NDims"]) == dimension + assert header["ElementType"] == "MET_DOUBLE" + assert int(header.get("ElementNumberOfChannels", "1")) == 1 + payload = path.parent / header["ElementDataFile"] + assert payload.is_file() and payload.stat().st_size > 0, payload + image = sitk.ReadImage(str(path)) + assert image.GetDimension() == dimension + assert image.GetNumberOfComponentsPerPixel() == 1 + assert image.GetPixelID() == sitk.sitkFloat64 + size = list(actor.size) + spacing = list(actor.spacing) + expected_origin = list(origin) + expected_direction = direction + if dimension == 4: + size += [actor.AMDM_Bins] + spacing += [1.0] + expected_origin += [0.0] + expected_direction = np.eye(4) + expected_direction[:3, :3] = direction + assert image.GetSize() == tuple(size) + np.testing.assert_allclose(image.GetSpacing(), spacing, rtol=0, atol=1e-12) + np.testing.assert_allclose(image.GetOrigin(), expected_origin, rtol=0, atol=1e-10) + np.testing.assert_allclose(np.array(image.GetDirection()).reshape(dimension, dimension), + expected_direction, rtol=0, atol=1e-12) + data = sitk.GetArrayFromImage(image) + assert data.dtype == np.float64 + assert data.shape == tuple(reversed(size)), (path, data.shape) + assert np.isfinite(data).all(), path + np.testing.assert_array_equal(data, itk.array_from_image(itk.imread(str(path)))) + if header.get("CompressedData", "False").lower() == "false": + assert payload.stat().st_size == data.size * 8 + if samples is not None: + # Current actor outputs record sample counts beside the image. + metadata = json.loads(path.with_name(path.stem + "-samples.mhd.json").read_text()) + assert metadata["number_of_samples"] == samples + return data + + +def check_outputs(sim, actor, which="merged", samples=None): + origin, direction = expected_metadata(sim, actor) + result = [] + for interface, dimension, suffix in [ + (actor.restrictedEdep, 3, "restrictedEdep"), + (actor.raw_delta, 4, "unprocessedForMergingOnly-delta"), + (actor.raw_gamma, 4, "unprocessedForMergingOnly-gamma"), + (actor.delta, 4, "delta"), + (actor.gamma, 4, "gamma"), + ]: + path = interface.get_output_path(which=which) + expected_name = f"result-{suffix}" + if which != "merged": + expected_name += f"-run{which}" + assert path.name == expected_name + ".mhd", path + assert path.parent.resolve() == Path(sim.output_dir).resolve() + if interface.active and interface.write_to_disk: + data = check_image(path, dimension, actor, origin, direction, samples) + np.testing.assert_array_equal(data, itk.array_from_image(interface.get_data(which))) + result.append(data) + else: + assert not path.exists(), path + return result + + +def assert_constant_scoring(actor, gamma=GAMMA, delta=DELTA): + energy, raw_delta, raw_gamma, normalized_delta, normalized_gamma = arrays(actor) + assert energy.sum() > 0, "simulation must score nonzero restricted energy" + assert np.any(energy == 0), "test must include empty voxels" + for b in range(actor.AMDM_Bins): + # Accumulation error only: constants make these exact scientific identities. + np.testing.assert_allclose(raw_delta[b], delta[b] * energy, rtol=1e-12, atol=1e-12) + np.testing.assert_allclose(raw_gamma[b], gamma[b] * raw_delta[b], rtol=1e-12, atol=1e-12) + np.testing.assert_allclose(normalized_delta[b][energy > 0], delta[b], rtol=1e-12, atol=1e-12) + expected_gamma = gamma[b] if delta[b] != 0 else 0 + np.testing.assert_allclose(normalized_gamma[b][energy > 0], expected_gamma, rtol=1e-12, atol=1e-12) + assert np.all(normalized_delta[b][energy == 0] == 0) + assert np.all(normalized_gamma[b][energy == 0] == 0) + return energy.sum() diff --git a/opengate/tests/src/actors/test110_amdm_lut.py b/opengate/tests/src/actors/test110_amdm_lut.py new file mode 100644 index 0000000000..d1bdf927aa --- /dev/null +++ b/opengate/tests/src/actors/test110_amdm_lut.py @@ -0,0 +1,73 @@ +#!/usr/bin/env python3 +"""Independent expectations for the bound C++ AMDM lookup and validation.""" +from pathlib import Path +import numpy as np +import opengate as gate +import opengate_core as g4 +from opengate.tests import utility +from opengate.actors.amdmoutput import ActorOutputAMDM +from opengate.actors.doseactors import AMDMActor +from test110_amdm_helpers import output_dir + + +def lookup_actor(path, bins=2): + sim = gate.Simulation() + actor = sim.add_actor("AMDMActor", "lookup") + actor.AMDM_Bins = bins + actor.LUTfilename = str(path) + actor.InitializeUserInfo(actor.user_info) + return actor + + +if __name__ == "__main__": + directory = output_dir("lut") + assert hasattr(g4, "GateAMDMActor") + assert AMDMActor.has_been_processed() and ActorOutputAMDM.has_been_processed() + path = directory / "lookup.txt" + # Unequal groups and a singleton final charge are valid. + path.write_text(" # comment\n\n1 1 2 8 .2 .8\n1 3 6 4 .6 .4 # inline\n" + "8 .9 3 9 .3 .7\n8 4 7 1 .7 .3\n10 2 11 13 .1 .9\n") + actor = lookup_actor(path) + np.testing.assert_array_equal(actor.Lookup(1, 1), [2, 8, .2, .8]) + np.testing.assert_allclose(actor.Lookup(1, 2), [4, 6, .4, .6], rtol=0, atol=1e-15) + np.testing.assert_array_equal(actor.Lookup(1, .01), [2, 8, .2, .8]) + np.testing.assert_array_equal(actor.Lookup(1, 99), [6, 4, .6, .4]) + for energy in [0, 2, 999, float("inf")]: + np.testing.assert_array_equal(actor.Lookup(10, energy), [11, 13, .1, .9]) + for charge in [0, 2, 9, 11]: + assert actor.Lookup(charge, 2) == [] + assert actor.Lookup(1, float("nan")) == [] + malformed = { + "empty": (" # nothing\n", "no data"), + "columns": ("1 1 2 8 .2\n", "column count"), + "negative_charge": ("-1 1 2 8 .2 .8\n", "charge"), + "fractional_charge": ("1.5 1 2 8 .2 .8\n", "charge"), + "zero_charge": ("0 1 2 8 .2 .8\n", "charge"), + "charge_overflow": ("1e20 1 2 8 .2 .8\n", "charge"), + "zero_energy": ("1 0 2 8 .2 .8\n", "energy"), + "duplicate": ("1 1 2 8 .2 .8\n1 1 6 4 .6 .4\n", "unique"), + "descending_energy": ("1 3 2 8 .2 .8\n1 1 6 4 .6 .4\n", "increasing"), + "descending_charge": ("8 1 2 8 .2 .8\n1 2 6 4 .6 .4\n", "groups"), + "nan": ("1 1 nan 8 .2 .8\n", "finite"), + "infinity": ("1 1 2 8 inf .8\n", "finite"), + "trailing_text": ("1 1 2 8 .2 .8 junk\n", "numeric"), + } + for name, (text, message) in malformed.items(): + bad_path = directory / f"{name}.txt" + bad_path.write_text(text) + try: + lookup_actor(bad_path) + except ValueError as error: + assert message in str(error), (name, error) + else: + raise AssertionError(f"accepted malformed LUT: {name}") + for bad_path, bins, message in [(directory / "missing.txt", 2, "cannot open"), + (path, 3, "column count"), (path, 0, "positive")]: + try: + lookup_actor(bad_path, bins) + except ValueError as error: + assert message in str(error), error + else: + raise AssertionError((bad_path, bins)) + print("Exact, interpolated, clamped, missing-charge and malformed LUT checks passed") + utility.test_ok(True) diff --git a/opengate/tests/src/actors/test110_amdm_multiple_runs.py b/opengate/tests/src/actors/test110_amdm_multiple_runs.py new file mode 100644 index 0000000000..99cedf4ec6 --- /dev/null +++ b/opengate/tests/src/actors/test110_amdm_multiple_runs.py @@ -0,0 +1,64 @@ +#!/usr/bin/env python3 +"""Unequal run contributions must merge raw data before deriving AMDM ratios.""" +import numpy as np +import opengate as gate +from opengate.actors.amdmoutput import ActorOutputAMDM +from opengate.tests import utility +from test110_amdm_helpers import ( + GAMMA, DELTA, output_dir, constant_lut, make_sim, arrays, check_outputs, +) + + +if __name__ == "__main__": + directory = output_dir("multiple_runs") + other_gamma = np.array([19., 3., 17.]) + other_delta = np.array([.8, .2, 0.]) + lut = constant_lut(directory, {6: (GAMMA, DELTA), 8: (other_gamma, other_delta)}) + sim, actor = make_sim(directory, lut=lut, primaries=[80, 0]) + first = sim.source_manager.sources["ions"] + second = sim.add_source("GenericSource", "oxygen") + second.particle = "ion 8 16" + second.energy.mono = 60 * gate.g4_units.MeV + second.number_of_primaries = [0, 240] + second.position.type = first.position.type + second.position.translation = list(first.position.translation) + second.direction.type = first.direction.type + second.direction.momentum = list(first.direction.momentum) + second.weight = 1.0 + actor.user_output.amdm.keep_data_per_run = True + sim.run_timing_intervals = [[0, 1], [1, 2]] + sim.run(start_new_process=True) + runs = [arrays(actor, i) for i in range(2)] + merged = arrays(actor) + for i, expected in enumerate([80, 240]): + check_outputs(sim, actor, which=i, samples=expected) + assert runs[i][0].sum() > 0 + check_outputs(sim, actor, samples=320) + for component in range(3): + np.testing.assert_allclose(merged[component], runs[0][component] + runs[1][component], + rtol=1e-12, atol=1e-10) + for i, (gamma, delta) in enumerate([(GAMMA, DELTA), (other_gamma, other_delta)]): + mask = runs[i][0] > 0 + for b in range(3): + np.testing.assert_allclose(runs[i][3][b][mask], delta[b], rtol=1e-12, atol=1e-12) + np.testing.assert_allclose(runs[i][4][b][mask], gamma[b] if delta[b] else 0, + rtol=1e-12, atol=1e-12) + for numerator, denominator, derived in [(1, 0, 3), (2, 1, 4)]: + expected = np.zeros_like(merged[numerator]) + np.divide(merged[numerator], merged[denominator], out=expected, + where=merged[denominator] != 0) + np.testing.assert_allclose(merged[derived], expected, rtol=1e-12, atol=1e-12) + wrong = (runs[0][derived] + runs[1][derived]) / 2 + assert not np.allclose(expected, wrong, rtol=1e-3, atol=1e-6), "case must detect ratio averaging" + # The actor-output in-memory merge contract must retain the same raw-first rule. + merged_output = ActorOutputAMDM(name="merged", belongs_to=actor, simulation=sim) + merged_output.merge_data_from_actor_output(actor.user_output.amdm, + actor.user_output.amdm) + for item in [0, 1, 2]: + np.testing.assert_allclose(merged_output.get_data(item=item), 2 * merged[item], + rtol=1e-12, atol=1e-10) + for item, index in [("delta", 3), ("gamma", 4)]: + np.testing.assert_allclose(merged_output.get_data(item=item), merged[index], + rtol=1e-12, atol=1e-12) + print("Unequal runs, continued scoring and raw-first output merging passed") + utility.test_ok(True) diff --git a/opengate/tests/src/actors/test110_amdm_scoring.py b/opengate/tests/src/actors/test110_amdm_scoring.py new file mode 100644 index 0000000000..a9dfaab5db --- /dev/null +++ b/opengate/tests/src/actors/test110_amdm_scoring.py @@ -0,0 +1,99 @@ +#!/usr/bin/env python3 +"""Analytical bin scoring, public configuration, geometry and output contract.""" +import itk +import numpy as np +import opengate as gate +from opengate.exception import GateDeprecationError +from opengate.tests import utility +from test110_amdm_helpers import ( + GAMMA, DELTA, constant_lut, arrays, output_dir, make_sim, + assert_constant_scoring, check_outputs, +) + + +if __name__ == "__main__": + scored = [] + for coordinate, hit, raw, weight in [("local", "pre", True, 1.0), + ("global", "post", False, 2.0), + (None, "middle", True, 1.0), + ("global", "random", True, 1.0)]: + directory = output_dir(f"scoring_{coordinate}_{hit}") + sim, actor = make_sim(directory, coordinate=coordinate, hit_type=hit, weight=weight) + actor.storeMergingData = raw + sim.run(start_new_process=True) + total = assert_constant_scoring(actor) + check_outputs(sim, actor, samples=80) + scored.append(total) + assert actor.user_output.amdm.merged_data.get_data_item_object(0).number_of_samples == 80 + # The same seeded fully-contained beam gives linear scaling with track weight. + # Hit position cannot change its total deposit in a grid covering the target. + np.testing.assert_allclose(scored[1], 2 * scored[0], rtol=1e-12, atol=1e-9) + sim, actor = make_sim(output_dir("image_coordinates"), + coordinate="attached_to_image", image_volume=True) + sim.run(start_new_process=True) + assert_constant_scoring(actor) + check_outputs(sim, actor, samples=80) + for invalid, value, message in [ + ("AMDM_Bins", 0, "positive integer"), + ("AMDM_Bins", 2.5, "positive integer"), + ("AMDM_Bins", True, "positive integer"), + ("size", [2, 0, 2], "positive integers"), + ("size", [2, 2.5, 2], "positive integers"), + ("spacing", [1, -1, 1], "greater than zero"), + ("translation", [0, float("nan"), 0], "finite"), + ("rotation", np.zeros((3, 3)), "orthonormal"), + ("LUTfilename", "", "nonempty"), + ]: + sim, actor = make_sim(output_dir("invalid")) + setattr(actor, invalid, value) + try: + actor.initialize() + except Exception as error: + assert message in str(error), (invalid, error) + else: + raise AssertionError(f"accepted invalid {invalid}={value}") + sim, actor = make_sim(output_dir("invalid")) + try: + actor.hit_type = "unknown" + except Exception as error: + assert "hit_type" in str(error) + else: + raise AssertionError("accepted unknown hit_type") + try: + actor.output = "old.mhd" + except GateDeprecationError: + pass + else: + raise AssertionError("obsolete output must use current deprecation behavior") + # Missing charge: initialization succeeds, but accepted energy and all bins are zero. + sim, actor = make_sim(output_dir("missing_charge"), particle="ion 8 16") + sim.run(start_new_process=True) + for array in arrays(actor): + assert np.all(array == 0) + check_outputs(sim, actor, samples=80) + for particle in ["gamma", "e-"]: + directory = output_dir("excluded_" + particle) + lut = constant_lut(directory, {1: (GAMMA, DELTA)}) + sim, actor = make_sim(directory, lut=lut, particle=particle) + sim.source_manager.sources["ions"].energy.mono = .5 + sim.run(start_new_process=True) + for array in arrays(actor): + assert np.all(array == 0) + # Preserve the legacy zero-baryon positive-charge rule explicitly: every + # positron query uses its charge's upper endpoint, not its finite kinetic energy. + directory = output_dir("positron_compatibility") + lut = directory / "positron_lut.txt" + lut.write_text("1 1 2 7 13 .25 .75 0\n1 10 5 11 17 .25 .75 0\n") + sim, actor = make_sim(directory, lut=lut, particle="e+") + sim.source_manager.sources["ions"].energy.mono = .5 + sim.run(start_new_process=True) + assert_constant_scoring(actor, gamma=[5, 11, 17]) + # Disk controls do not disable the internal denominators needed by derived views. + sim, actor = make_sim(output_dir("no_disk")) + actor.write_to_disk = False + actor.storeMergingData = True + sim.run(start_new_process=True) + assert_constant_scoring(actor) + assert not list(sim.output_dir.glob("*.mhd")) + print("Analytical scoring, zero denominators, metadata and configuration checks passed") + utility.test_ok(True) diff --git a/opengate/tests/src/actors/test110_amdm_supplied_lut.py b/opengate/tests/src/actors/test110_amdm_supplied_lut.py new file mode 100644 index 0000000000..feda38839d --- /dev/null +++ b/opengate/tests/src/actors/test110_amdm_supplied_lut.py @@ -0,0 +1,73 @@ +#!/usr/bin/env python3 +"""Supplied-table acceptance, checked against independently recorded transport steps.""" +from pathlib import Path +import hashlib +import numpy as np +import uproot +import opengate as gate +from opengate.tests import utility +from test110_amdm_helpers import output_dir, make_sim, arrays, check_outputs + +LUT_SHA256 = "93d42113b9f48e3ec069000f5983e4568f7bca2e873d1cb06186d08f949771ab" + + +if __name__ == "__main__": + lut = Path(__file__).resolve().parent / "fixtures" / "test110_amdm" / "AMDM_LUT.txt" + assert lut.is_file(), f"AMDM acceptance requires its development LUT fixture: {lut}" + checksum = hashlib.sha256(lut.read_bytes()).hexdigest() + assert checksum == LUT_SHA256, checksum + table = np.loadtxt(lut) + assert table.shape == (4000, 22) + assert (table[:, 0] == 8).sum() == 401 and (table[:, 0] == 9).sum() == 399 + directory = output_dir("supplied_lut") + sim, actor = make_sim(directory, lut=lut, primaries=40) + actor.AMDM_Bins = 10 + actor.InitializeUserInfo(actor.user_info) + for charge in range(1, 11): + group = table[table[:, 0] == charge] + queries = [0.0, group[0, 1], (group[0, 1] + group[1, 1]) / 2, + group[-1, 1], group[-1, 1] + 100] + for energy in queries: + expected_lookup = [np.interp(energy, group[:, 1], group[:, c]) + for c in range(2, 22)] + np.testing.assert_allclose(actor.Lookup(charge, energy), expected_lookup, + rtol=1e-13, atol=1e-13) + # Public PhaseSpaceActor records every step independently of AMDM scoring. + audit = sim.add_actor("PhaseSpaceActor", "steps") + audit.attached_to = "phantom" + audit.steps_to_store = "all" + audit.attributes = ["PDGCode", "PostKineticEnergy", "PreKineticEnergy", + "TotalEnergyDeposit", "Weight"] + audit.output_filename = "steps.root" + sim.run(start_new_process=True) + steps = uproot.open(audit.get_output_path())["steps"].arrays(library="numpy") + # This low-energy EM-only carbon case has no nuclear fragmentation. Verify + # the assertion rather than assuming the transport had no other ion species. + code = steps["PDGCode"] + mask = code == 1000060120 # carbon-12, charge 6, baryon number 12 + positive = (code > 1_000_000_000) | (code == 2212) | (code == -11) + assert mask.any() and np.all(code[positive] == 1000060120), np.unique(code) + energies = steps["PostKineticEnergy"][mask] / 12.0 + weights = steps["TotalEnergyDeposit"][mask] * steps["Weight"][mask] + assert weights.sum() > 0 and np.ptp(energies) > 1, "must exercise energy-dependent lookup" + group = table[table[:, 0] == 6] + expected = np.column_stack([np.interp(energies, group[:, 1], group[:, c]) + for c in range(2, 22)]) + expected_delta = (expected[:, 10:] * weights[:, None]).sum(axis=0) + expected_gamma = (expected[:, :10] * expected[:, 10:] * weights[:, None]).sum(axis=0) + energy, raw_delta, raw_gamma, delta, gamma = arrays(actor) + # Independent step recording, unit conversion and np.interp oracle: allow + # only floating-point summation order error, not Monte Carlo disagreement. + np.testing.assert_allclose(energy.sum(), weights.sum(), rtol=1e-11, atol=1e-8) + np.testing.assert_allclose(raw_delta.sum(axis=(1, 2, 3)), expected_delta, rtol=1e-11, atol=1e-8) + np.testing.assert_allclose(raw_gamma.sum(axis=(1, 2, 3)), expected_gamma, rtol=1e-11, atol=1e-8) + scored = energy > 0 + np.testing.assert_allclose(delta[:, scored].sum(axis=0), 1., rtol=0, atol=1e-12) + assert np.all(delta >= 0) and np.all(delta <= 1 + 1e-12) + assert np.all(gamma >= 0) and np.isfinite(gamma).all() + assert np.all(delta[:, ~scored] == 0) and np.all(gamma[:, ~scored] == 0) + check_outputs(sim, actor, samples=40) + print("Supplied LUT", lut, checksum) + print("Recorded carbon steps", mask.sum(), "restricted MeV", energy.sum()) + print("Independent np.interp/transport-step oracle passed for all ten raw bins") + utility.test_ok(True) diff --git a/opengate/tests/src/actors/test110_amdm_threads.py b/opengate/tests/src/actors/test110_amdm_threads.py new file mode 100644 index 0000000000..20537e9b2d --- /dev/null +++ b/opengate/tests/src/actors/test110_amdm_threads.py @@ -0,0 +1,20 @@ +#!/usr/bin/env python3 +"""Scientifically relevant ST/MT aggregates and exact constant-bin identities.""" +import numpy as np +from opengate.tests import utility +from test110_amdm_helpers import output_dir, make_sim, assert_constant_scoring, check_outputs + + +if __name__ == "__main__": + totals = [] + for threads in [1, 2]: + sim, actor = make_sim(output_dir(f"threads_{threads}"), threads=threads, primaries=400) + sim.run(start_new_process=True) + totals.append(assert_constant_scoring(actor)) + check_outputs(sim, actor, samples=400) + # Different thread scheduling uses different random streams. The small fully + # contained beam has almost deterministic total deposition; 2% allows its + # transport fluctuations while exposing lost/raced updates or duplicated events. + np.testing.assert_allclose(totals[1], totals[0], rtol=.02, atol=0) + print("ST/MT weighted energy totals", totals) + utility.test_ok(True) diff --git a/simulation.json b/simulation.json new file mode 100644 index 0000000000..a8e7d50099 --- /dev/null +++ b/simulation.json @@ -0,0 +1,573 @@ +{ + "user_info": { + "verbose_level": "INFO", + "log_sink": null, + "verbose_close": false, + "verbose_getstate": false, + "running_verbose_level": 0, + "g4_verbose_level": 1, + "g4_verbose": false, + "g4_verbose_level_tracking": -1, + "visu": false, + "visu_type": "vrml", + "visu_filename": null, + "visu_verbose": false, + "visu_commands": [ + "# default visualization", + "#/vis/open OGLSQt", + "/vis/open OGLIQt", + "/vis/scene/create", + "/vis/drawVolume worlds", + "/vis/viewer/flush", + "# no verbose", + "/control/verbose 0", + "# Work but generate txt on terminal", + "/vis/scene/add/axes 0 0 0 50 cm", + "/vis/scene/add/text 10 0 0 cm 20 0 0 X # red", + "/vis/scene/add/text 0 10 0 cm 20 0 0 Y # green", + "/vis/scene/add/text 0 0 10 cm 20 0 0 Z # blue", + "# change orientation (for debug)", + "#/vis/viewer/set/upVector 0 0 1", + "#/vis/viewer/set/viewpointVector 0 1 0", + "#/vis/viewer/set/upVector 1 0 0", + "#/vis/viewer/set/viewpointVector 0 0 1", + "#/vis/viewer/set/upVector 0 1 0", + "#/vis/viewer/set/viewpointVector 1 0 0", + "/vis/sceneHandler/attach", + "/vis/modeling/trajectories/create/drawByParticleID", + "/tracking/storeTrajectory 1", + "/vis/scene/endOfEventAction accumulate", + "/vis/scene/add/trajectories", + "/vis/viewer/set/auxiliaryEdge true" + ], + "visu_commands_vrml": [ + "/vis/open VRML2FILE", + "/vis/drawVolume worlds", + "/vis/modeling/trajectories/create/drawByParticleID", + "/tracking/storeTrajectory 1", + "/vis/scene/add/trajectories", + "/vis/scene/endOfEventAction accumulate", + "/vis/scene/backgroundColour 0 0 0", + "#/vis/viewer/flush" + ], + "visu_commands_gdml": [ + "/vis/open OGLI 600x600-0+0", + "/vis/viewer/set/autoRefresh false", + "/vis/verbose errors", + "/vis/drawVolume worlds", + "/vis/modeling/trajectories/create/drawByParticleID", + "/tracking/storeTrajectory 1", + "/vis/scene/add/trajectories", + "/vis/scene/endOfEventAction accumulate", + "/vis/viewer/set/autoRefresh true", + "/vis/verbose warnings", + "#/vis/viewer/flush" + ], + "check_volumes_overlap": true, + "number_of_threads": 2, + "force_multithread_mode": false, + "random_engine": "MixMaxRng", + "random_seed": "auto", + "current_random_seed": 712304050846155017, + "run_timing_intervals": [ + [ + 0.0, + 1000000000.0 + ] + ], + "simulation_dir": { + "__pathlib_path__": [ + "." + ] + }, + "output_dir": { + "__pathlib_path__": [ + "/", + "opt", + "simulation", + "opengate_dev", + "opengate_dev_gitfuchs", + "opengate", + "tests", + "output", + "test102_debug_actor" + ] + }, + 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"max_rejection": 10000, + "target_volumes": [], + "enable_intersection_check": false, + "enable_angle_check": false, + "angle_check_reference_vector": [ + 0, + 0, + 1 + ], + "angle_check_proximity_distance": 0.0, + "angle_tolerance_proximal": 1.5707963267948966, + "angle_tolerance_min": 0.0, + "angle_tolerance_max": 0.10471975511965978 + }, + "accolinearity_flag": false, + "accolinearity_fwhm": 0.008726646259971648, + "histogram_theta_weights": [], + "histogram_theta_angles": [], + "histogram_phi_weights": [], + "histogram_phi_angles": [] + }, + "energy": { + "type": "mono", + "mono": 1.0, + "sigma_gauss": 0, + "is_cdf": false, + "min_energy": null, + "max_energy": null, + "spectrum_type": null, + "spectrum_weights": [], + "spectrum_energies": [], + "histogram_weight": [], + "histogram_energy": [], + "spectrum_energy_bin_edges": [], + "spectrum_histogram_interpolation": null + }, + "polarization": [], + "visualization": { + "count": 2000, + "color": "yellow", + "size": 2 + }, + "attached_to": "world", + "mother": null, + "start_time": 0.0, + "end_time": 1000000000.0, + "number_of_primaries": { + "__ndarray__": [ + 2 + ], + "__dtype__": "int64", + "__shape__": [ + 1 + ] + }, + "n": 0, + "activity": 0, + "half_life": -1, + "dynamic_params": null, + "name": "mysource" + }, + "object_type": "GenericSource", + "object_type_full": "", + "class_module": "opengate.sources.generic", + "i_am_a_gate_object": true + } + } + }, + "auxiliary_attributes": {} +} \ No newline at end of file From 77adc6e009c8eb4ae40a5339ce9babbb95f8b5ba Mon Sep 17 00:00:00 2001 From: "pre-commit-ci[bot]" <66853113+pre-commit-ci[bot]@users.noreply.github.com> Date: Thu, 1 Oct 2026 10:12:16 +0000 Subject: [PATCH 2/4] [pre-commit.ci] Automatic python and c++ formatting --- .../opengate_lib/GateAMDMActor.cpp | 27 +- .../opengate_lib/GateAMDMActor.h | 3 +- .../GateAMDMActor_lookUpTable.cpp | 11 +- .../opengate_lib/pyGateAMDMActor.cpp | 18 +- opengate/actors/doseactors.py | 20 +- .../tests/src/actors/test110_amdm_helpers.py | 74 +- opengate/tests/src/actors/test110_amdm_lut.py | 28 +- .../src/actors/test110_amdm_multiple_runs.py | 58 +- .../tests/src/actors/test110_amdm_scoring.py | 46 +- .../src/actors/test110_amdm_supplied_lut.py | 52 +- .../tests/src/actors/test110_amdm_threads.py | 15 +- simulation.json | 1096 ++++++++--------- 12 files changed, 792 insertions(+), 656 deletions(-) diff --git a/core/opengate_core/opengate_lib/GateAMDMActor.cpp b/core/opengate_core/opengate_lib/GateAMDMActor.cpp index 205b9ccafb..e44b6c17f2 100644 --- a/core/opengate_core/opengate_lib/GateAMDMActor.cpp +++ b/core/opengate_core/opengate_lib/GateAMDMActor.cpp @@ -12,7 +12,8 @@ #include #include -GateAMDMActor::GateAMDMActor(py::dict &user_info) : GateVActor(user_info, true) {} +GateAMDMActor::GateAMDMActor(py::dict &user_info) + : GateVActor(user_info, true) {} void GateAMDMActor::InitializeUserInfo(py::dict &user_info) { GateVActor::InitializeUserInfo(user_info); @@ -20,7 +21,8 @@ void GateAMDMActor::InitializeUserInfo(py::dict &user_info) { fHitType = DictGetStr(user_info, "hit_type"); if (fHitType != "random" && fHitType != "pre" && fHitType != "post" && fHitType != "middle") - throw std::invalid_argument("AMDM hit_type must be random, pre, post or middle"); + throw std::invalid_argument( + "AMDM hit_type must be random, pre, post or middle"); fTranslation = DictGetG4ThreeVector(user_info, "translation"); fRotation = DictGetG4RotationMatrix(user_info, "rotation"); fTable.Read(DictGetStr(user_info, "LUTfilename"), fBins); @@ -42,12 +44,13 @@ void GateAMDMActor::BeginOfRunActionMasterThread(int) { ComputeTransformationFromVolumeToWorld(fPhysicalVolumeName, volumeTranslation, volumeRotation, true); G4ThreeVector center; - const auto size = cpp_amdm_restricted_edep_image->GetLargestPossibleRegion().GetSize(); + const auto size = + cpp_amdm_restricted_edep_image->GetLargestPossibleRegion().GetSize(); const auto spacing = cpp_amdm_restricted_edep_image->GetSpacing(); for (unsigned int i = 0; i < 3; ++i) center[i] = -(size[i] - 1.0) * spacing[i] / 2.0; - const auto spatialOrigin = volumeTranslation + - volumeRotation * (fRotation * center + fTranslation); + const auto spatialOrigin = + volumeTranslation + volumeRotation * (fRotation * center + fTranslation); const auto spatialRotation = volumeRotation * fRotation; ImageType::PointType origin3; ImageType::DirectionType direction3; @@ -99,7 +102,8 @@ void GateAMDMActor::SteppingAction(G4Step *step) { for (unsigned int i = 0; i < 3; ++i) point[i] = position[i]; ImageType::IndexType index; - if (!cpp_amdm_restricted_edep_image->TransformPhysicalPointToIndex(point, index)) + if (!cpp_amdm_restricted_edep_image->TransformPhysicalPointToIndex(point, + index)) return; const auto *track = step->GetTrack(); const int charge = static_cast(track->GetDefinition()->GetPDGCharge()); @@ -109,14 +113,15 @@ void GateAMDMActor::SteppingAction(G4Step *step) { const double kineticEnergy = track->GetKineticEnergy() / CLHEP::MeV; // Preserve legacy applicability, including its zero-baryon rule: positive // energy / 0 samples the upper endpoint; 0 / 0 contributes nothing. - const double energy = mass == 0 - ? (kineticEnergy > 0 ? std::numeric_limits::infinity() - : std::numeric_limits::quiet_NaN()) - : kineticEnergy / mass; + const double energy = + mass == 0 ? (kineticEnergy > 0 ? std::numeric_limits::infinity() + : std::numeric_limits::quiet_NaN()) + : kineticEnergy / mass; auto values = Lookup(charge, energy); if (values.empty()) return; - const double edep = step->GetTotalEnergyDeposit() / CLHEP::MeV * track->GetWeight(); + const double edep = + step->GetTotalEnergyDeposit() / CLHEP::MeV * track->GetWeight(); ImageType4D::IndexType index4; for (unsigned int i = 0; i < 3; ++i) index4[i] = index[i]; diff --git a/core/opengate_core/opengate_lib/GateAMDMActor.h b/core/opengate_core/opengate_lib/GateAMDMActor.h index 36a04eacda..cf90f60e1b 100644 --- a/core/opengate_core/opengate_lib/GateAMDMActor.h +++ b/core/opengate_core/opengate_lib/GateAMDMActor.h @@ -27,7 +27,8 @@ class GateAMDMActor : public GateVActor { std::vector Lookup(int charge, double energy) const; ImageType::Pointer cpp_amdm_restricted_edep_image; - ImageType4D::Pointer cpp_amdm_delta_image; // raw sums, never normalized in place + ImageType4D::Pointer + cpp_amdm_delta_image; // raw sums, never normalized in place ImageType4D::Pointer cpp_amdm_gamma_image; int NbOfEvent = 0; diff --git a/core/opengate_core/opengate_lib/GateAMDMActor_lookUpTable.cpp b/core/opengate_core/opengate_lib/GateAMDMActor_lookUpTable.cpp index 0c0d063869..b6b068c793 100644 --- a/core/opengate_core/opengate_lib/GateAMDMActor_lookUpTable.cpp +++ b/core/opengate_core/opengate_lib/GateAMDMActor_lookUpTable.cpp @@ -53,7 +53,8 @@ void GateAMDMLookUpTable::Read(const std::string &filename, int bins) { fail("energy keys must be positive (MeV/n)"); auto &group = data[charge]; if (!group.empty() && columns[1] <= group.back().energy) - fail("energy keys must be unique and strictly increasing within a charge"); + fail( + "energy keys must be unique and strictly increasing within a charge"); group.push_back({columns[1], {columns.begin() + 2, columns.end()}}); previousCharge = charge; } @@ -65,7 +66,7 @@ void GateAMDMLookUpTable::Read(const std::string &filename, int bins) { } bool GateAMDMLookUpTable::Find(int charge, double energy, - std::vector &values) const { + std::vector &values) const { values.clear(); auto found = fData.find(charge); if (found == fData.end() || std::isnan(energy)) @@ -84,10 +85,12 @@ bool GateAMDMLookUpTable::Find(int charge, double energy, values = upper->values; } else { const auto &lower = *std::prev(upper); - const double fraction = (energy - lower.energy) / (upper->energy - lower.energy); + const double fraction = + (energy - lower.energy) / (upper->energy - lower.energy); values.resize(lower.values.size()); for (size_t b = 0; b < values.size(); ++b) - values[b] = lower.values[b] + fraction * (upper->values[b] - lower.values[b]); + values[b] = + lower.values[b] + fraction * (upper->values[b] - lower.values[b]); } } return true; diff --git a/core/opengate_core/opengate_lib/pyGateAMDMActor.cpp b/core/opengate_core/opengate_lib/pyGateAMDMActor.cpp index 7fb2c859c8..49ffdd59cc 100644 --- a/core/opengate_core/opengate_lib/pyGateAMDMActor.cpp +++ b/core/opengate_core/opengate_lib/pyGateAMDMActor.cpp @@ -7,7 +7,8 @@ class PyGateAMDMActor : public GateAMDMActor { public: using GateAMDMActor::GateAMDMActor; void BeginOfRunActionMasterThread(int run_id) override { - PYBIND11_OVERLOAD(void, GateAMDMActor, BeginOfRunActionMasterThread, run_id); + PYBIND11_OVERLOAD(void, GateAMDMActor, BeginOfRunActionMasterThread, + run_id); } int EndOfRunActionMasterThread(int run_id) override { PYBIND11_OVERLOAD(int, GateAMDMActor, EndOfRunActionMasterThread, run_id); @@ -19,14 +20,19 @@ void init_GateAMDMActor(py::module &m) { std::unique_ptr, GateVActor>( m, "GateAMDMActor") .def(py::init()) - .def("BeginOfRunActionMasterThread", &GateAMDMActor::BeginOfRunActionMasterThread) - .def("EndOfRunActionMasterThread", &GateAMDMActor::EndOfRunActionMasterThread) + .def("BeginOfRunActionMasterThread", + &GateAMDMActor::BeginOfRunActionMasterThread) + .def("EndOfRunActionMasterThread", + &GateAMDMActor::EndOfRunActionMasterThread) .def_readwrite("cpp_amdm_restricted_edep_image", &GateAMDMActor::cpp_amdm_restricted_edep_image) - .def_readwrite("cpp_amdm_delta_image", &GateAMDMActor::cpp_amdm_delta_image) - .def_readwrite("cpp_amdm_gamma_image", &GateAMDMActor::cpp_amdm_gamma_image) + .def_readwrite("cpp_amdm_delta_image", + &GateAMDMActor::cpp_amdm_delta_image) + .def_readwrite("cpp_amdm_gamma_image", + &GateAMDMActor::cpp_amdm_gamma_image) .def_readonly("NbOfEvent", &GateAMDMActor::NbOfEvent) - .def("Lookup", &GateAMDMActor::Lookup, py::arg("charge"), py::arg("energy")) + .def("Lookup", &GateAMDMActor::Lookup, py::arg("charge"), + py::arg("energy")) .def("GetPhysicalVolumeName", &GateAMDMActor::GetPhysicalVolumeName) .def("SetPhysicalVolumeName", &GateAMDMActor::SetPhysicalVolumeName); } diff --git a/opengate/actors/doseactors.py b/opengate/actors/doseactors.py index 660c23e0fc..240bce13e8 100644 --- a/opengate/actors/doseactors.py +++ b/opengate/actors/doseactors.py @@ -2228,7 +2228,9 @@ class AMDMActor(VoxelDepositActor, g4.GateAMDMActor): ), "AMDM_Bins": ( 10, - {"doc": "Positive integer bin count; LUT must have 2 + 2*AMDM_Bins columns."}, + { + "doc": "Positive integer bin count; LUT must have 2 + 2*AMDM_Bins columns." + }, ), "storeMergingData": ( False, @@ -2324,17 +2326,23 @@ def initialize(self): fatal("AMDM size must contain three positive integers") for name in ("spacing", "translation"): value = np.asarray(getattr(self, name), dtype=float) - if value.shape != (3,) or not np.all(np.isfinite(value)) or ( - name == "spacing" and np.any(value <= 0) + if ( + value.shape != (3,) + or not np.all(np.isfinite(value)) + or (name == "spacing" and np.any(value <= 0)) ): fatal( f"AMDM {name} must contain three finite values" + (" greater than zero" if name == "spacing" else "") ) rotation = np.asarray(self.rotation, dtype=float) - if rotation.shape != (3, 3) or not np.all(np.isfinite(rotation)) or not ( - np.allclose(rotation.T @ rotation, np.eye(3), atol=1e-10, rtol=0) - and np.isclose(np.linalg.det(rotation), 1, atol=1e-10, rtol=0) + if ( + rotation.shape != (3, 3) + or not np.all(np.isfinite(rotation)) + or not ( + np.allclose(rotation.T @ rotation, np.eye(3), atol=1e-10, rtol=0) + and np.isclose(np.linalg.det(rotation), 1, atol=1e-10, rtol=0) + ) ): fatal("AMDM rotation must be a proper orthonormal 3x3 matrix") if not isinstance(self.LUTfilename, (str, Path)) or not str(self.LUTfilename): diff --git a/opengate/tests/src/actors/test110_amdm_helpers.py b/opengate/tests/src/actors/test110_amdm_helpers.py index 3c8ba75c10..98fb908f49 100644 --- a/opengate/tests/src/actors/test110_amdm_helpers.py +++ b/opengate/tests/src/actors/test110_amdm_helpers.py @@ -30,13 +30,23 @@ def constant_lut(directory, entries=None): stream.write(" # charge energy[MeV/n] gamma[keV/um] delta\n\n") for charge, (gamma, delta) in sorted(entries.items()): for energy in [1.0, 10.0]: - stream.write(" ".join(map(str, [charge, energy, *gamma, *delta])) + "\n") + stream.write( + " ".join(map(str, [charge, energy, *gamma, *delta])) + "\n" + ) return path -def make_sim(directory, lut=None, threads=1, weight=1.0, hit_type="pre", - coordinate="local", particle="ion 6 12", primaries=80, - image_volume=False): +def make_sim( + directory, + lut=None, + threads=1, + weight=1.0, + hit_type="pre", + coordinate="local", + particle="ion 6 12", + primaries=80, + image_volume=False, +): directory = Path(directory) sim = gate.Simulation() sim.output_dir = directory @@ -51,6 +61,7 @@ def make_sim(directory, lut=None, threads=1, weight=1.0, hit_type="pre", phantom = sim.add_volume("Image" if image_volume else "Box", "phantom") if image_volume: from opengate.image import create_3d_image + image = create_3d_image([5, 5, 5], [8, 8, 8], origin=[19, -11, 4]) image.SetDirection(Rotation.from_euler("y", 15, degrees=True).as_matrix()) image_path = directory / "volume.mhd" @@ -80,17 +91,25 @@ def make_sim(directory, lut=None, threads=1, weight=1.0, hit_type="pre", source.number_of_primaries = primaries source.weight = weight source.position.type = "point" - source.position.translation = (np.asarray(phantom.translation) - + phantom.rotation @ actor.translation).tolist() + source.position.translation = ( + np.asarray(phantom.translation) + phantom.rotation @ actor.translation + ).tolist() source.direction.type = "momentum" source.direction.momentum = (phantom.rotation @ actor.rotation @ [0, 0, 1]).tolist() return sim, actor def arrays(actor, which="merged"): - return tuple(itk.array_from_image(interface.get_data(which=which)) - for interface in (actor.restrictedEdep, actor.raw_delta, - actor.raw_gamma, actor.delta, actor.gamma)) + return tuple( + itk.array_from_image(interface.get_data(which=which)) + for interface in ( + actor.restrictedEdep, + actor.raw_delta, + actor.raw_gamma, + actor.delta, + actor.gamma, + ) + ) def expected_metadata(sim, actor): @@ -115,8 +134,9 @@ def check_image(path, dimension, actor, origin, direction, samples=None): """Parse the header/payload independently with SimpleITK and compare to ITK.""" path = Path(path) assert path.is_file(), path - header = dict(line.split(" = ", 1) for line in path.read_text().splitlines() - if " = " in line) + header = dict( + line.split(" = ", 1) for line in path.read_text().splitlines() if " = " in line + ) assert int(header["NDims"]) == dimension assert header["ElementType"] == "MET_DOUBLE" assert int(header.get("ElementNumberOfChannels", "1")) == 1 @@ -139,8 +159,12 @@ def check_image(path, dimension, actor, origin, direction, samples=None): assert image.GetSize() == tuple(size) np.testing.assert_allclose(image.GetSpacing(), spacing, rtol=0, atol=1e-12) np.testing.assert_allclose(image.GetOrigin(), expected_origin, rtol=0, atol=1e-10) - np.testing.assert_allclose(np.array(image.GetDirection()).reshape(dimension, dimension), - expected_direction, rtol=0, atol=1e-12) + np.testing.assert_allclose( + np.array(image.GetDirection()).reshape(dimension, dimension), + expected_direction, + rtol=0, + atol=1e-12, + ) data = sitk.GetArrayFromImage(image) assert data.dtype == np.float64 assert data.shape == tuple(reversed(size)), (path, data.shape) @@ -150,7 +174,9 @@ def check_image(path, dimension, actor, origin, direction, samples=None): assert payload.stat().st_size == data.size * 8 if samples is not None: # Current actor outputs record sample counts beside the image. - metadata = json.loads(path.with_name(path.stem + "-samples.mhd.json").read_text()) + metadata = json.loads( + path.with_name(path.stem + "-samples.mhd.json").read_text() + ) assert metadata["number_of_samples"] == samples return data @@ -173,7 +199,9 @@ def check_outputs(sim, actor, which="merged", samples=None): assert path.parent.resolve() == Path(sim.output_dir).resolve() if interface.active and interface.write_to_disk: data = check_image(path, dimension, actor, origin, direction, samples) - np.testing.assert_array_equal(data, itk.array_from_image(interface.get_data(which))) + np.testing.assert_array_equal( + data, itk.array_from_image(interface.get_data(which)) + ) result.append(data) else: assert not path.exists(), path @@ -186,11 +214,19 @@ def assert_constant_scoring(actor, gamma=GAMMA, delta=DELTA): assert np.any(energy == 0), "test must include empty voxels" for b in range(actor.AMDM_Bins): # Accumulation error only: constants make these exact scientific identities. - np.testing.assert_allclose(raw_delta[b], delta[b] * energy, rtol=1e-12, atol=1e-12) - np.testing.assert_allclose(raw_gamma[b], gamma[b] * raw_delta[b], rtol=1e-12, atol=1e-12) - np.testing.assert_allclose(normalized_delta[b][energy > 0], delta[b], rtol=1e-12, atol=1e-12) + np.testing.assert_allclose( + raw_delta[b], delta[b] * energy, rtol=1e-12, atol=1e-12 + ) + np.testing.assert_allclose( + raw_gamma[b], gamma[b] * raw_delta[b], rtol=1e-12, atol=1e-12 + ) + np.testing.assert_allclose( + normalized_delta[b][energy > 0], delta[b], rtol=1e-12, atol=1e-12 + ) expected_gamma = gamma[b] if delta[b] != 0 else 0 - np.testing.assert_allclose(normalized_gamma[b][energy > 0], expected_gamma, rtol=1e-12, atol=1e-12) + np.testing.assert_allclose( + normalized_gamma[b][energy > 0], expected_gamma, rtol=1e-12, atol=1e-12 + ) assert np.all(normalized_delta[b][energy == 0] == 0) assert np.all(normalized_gamma[b][energy == 0] == 0) return energy.sum() diff --git a/opengate/tests/src/actors/test110_amdm_lut.py b/opengate/tests/src/actors/test110_amdm_lut.py index d1bdf927aa..1f7cad5ed3 100644 --- a/opengate/tests/src/actors/test110_amdm_lut.py +++ b/opengate/tests/src/actors/test110_amdm_lut.py @@ -1,5 +1,6 @@ #!/usr/bin/env python3 """Independent expectations for the bound C++ AMDM lookup and validation.""" + from pathlib import Path import numpy as np import opengate as gate @@ -25,15 +26,17 @@ def lookup_actor(path, bins=2): assert AMDMActor.has_been_processed() and ActorOutputAMDM.has_been_processed() path = directory / "lookup.txt" # Unequal groups and a singleton final charge are valid. - path.write_text(" # comment\n\n1 1 2 8 .2 .8\n1 3 6 4 .6 .4 # inline\n" - "8 .9 3 9 .3 .7\n8 4 7 1 .7 .3\n10 2 11 13 .1 .9\n") + path.write_text( + " # comment\n\n1 1 2 8 .2 .8\n1 3 6 4 .6 .4 # inline\n" + "8 .9 3 9 .3 .7\n8 4 7 1 .7 .3\n10 2 11 13 .1 .9\n" + ) actor = lookup_actor(path) - np.testing.assert_array_equal(actor.Lookup(1, 1), [2, 8, .2, .8]) - np.testing.assert_allclose(actor.Lookup(1, 2), [4, 6, .4, .6], rtol=0, atol=1e-15) - np.testing.assert_array_equal(actor.Lookup(1, .01), [2, 8, .2, .8]) - np.testing.assert_array_equal(actor.Lookup(1, 99), [6, 4, .6, .4]) + np.testing.assert_array_equal(actor.Lookup(1, 1), [2, 8, 0.2, 0.8]) + np.testing.assert_allclose(actor.Lookup(1, 2), [4, 6, 0.4, 0.6], rtol=0, atol=1e-15) + np.testing.assert_array_equal(actor.Lookup(1, 0.01), [2, 8, 0.2, 0.8]) + np.testing.assert_array_equal(actor.Lookup(1, 99), [6, 4, 0.6, 0.4]) for energy in [0, 2, 999, float("inf")]: - np.testing.assert_array_equal(actor.Lookup(10, energy), [11, 13, .1, .9]) + np.testing.assert_array_equal(actor.Lookup(10, energy), [11, 13, 0.1, 0.9]) for charge in [0, 2, 9, 11]: assert actor.Lookup(charge, 2) == [] assert actor.Lookup(1, float("nan")) == [] @@ -61,13 +64,18 @@ def lookup_actor(path, bins=2): assert message in str(error), (name, error) else: raise AssertionError(f"accepted malformed LUT: {name}") - for bad_path, bins, message in [(directory / "missing.txt", 2, "cannot open"), - (path, 3, "column count"), (path, 0, "positive")]: + for bad_path, bins, message in [ + (directory / "missing.txt", 2, "cannot open"), + (path, 3, "column count"), + (path, 0, "positive"), + ]: try: lookup_actor(bad_path, bins) except ValueError as error: assert message in str(error), error else: raise AssertionError((bad_path, bins)) - print("Exact, interpolated, clamped, missing-charge and malformed LUT checks passed") + print( + "Exact, interpolated, clamped, missing-charge and malformed LUT checks passed" + ) utility.test_ok(True) diff --git a/opengate/tests/src/actors/test110_amdm_multiple_runs.py b/opengate/tests/src/actors/test110_amdm_multiple_runs.py index 99cedf4ec6..fe9bf3dfe0 100644 --- a/opengate/tests/src/actors/test110_amdm_multiple_runs.py +++ b/opengate/tests/src/actors/test110_amdm_multiple_runs.py @@ -1,18 +1,24 @@ #!/usr/bin/env python3 """Unequal run contributions must merge raw data before deriving AMDM ratios.""" + import numpy as np import opengate as gate from opengate.actors.amdmoutput import ActorOutputAMDM from opengate.tests import utility from test110_amdm_helpers import ( - GAMMA, DELTA, output_dir, constant_lut, make_sim, arrays, check_outputs, + GAMMA, + DELTA, + output_dir, + constant_lut, + make_sim, + arrays, + check_outputs, ) - if __name__ == "__main__": directory = output_dir("multiple_runs") - other_gamma = np.array([19., 3., 17.]) - other_delta = np.array([.8, .2, 0.]) + other_gamma = np.array([19.0, 3.0, 17.0]) + other_delta = np.array([0.8, 0.2, 0.0]) lut = constant_lut(directory, {6: (GAMMA, DELTA), 8: (other_gamma, other_delta)}) sim, actor = make_sim(directory, lut=lut, primaries=[80, 0]) first = sim.source_manager.sources["ions"] @@ -35,30 +41,46 @@ assert runs[i][0].sum() > 0 check_outputs(sim, actor, samples=320) for component in range(3): - np.testing.assert_allclose(merged[component], runs[0][component] + runs[1][component], - rtol=1e-12, atol=1e-10) + np.testing.assert_allclose( + merged[component], + runs[0][component] + runs[1][component], + rtol=1e-12, + atol=1e-10, + ) for i, (gamma, delta) in enumerate([(GAMMA, DELTA), (other_gamma, other_delta)]): mask = runs[i][0] > 0 for b in range(3): - np.testing.assert_allclose(runs[i][3][b][mask], delta[b], rtol=1e-12, atol=1e-12) - np.testing.assert_allclose(runs[i][4][b][mask], gamma[b] if delta[b] else 0, - rtol=1e-12, atol=1e-12) + np.testing.assert_allclose( + runs[i][3][b][mask], delta[b], rtol=1e-12, atol=1e-12 + ) + np.testing.assert_allclose( + runs[i][4][b][mask], gamma[b] if delta[b] else 0, rtol=1e-12, atol=1e-12 + ) for numerator, denominator, derived in [(1, 0, 3), (2, 1, 4)]: expected = np.zeros_like(merged[numerator]) - np.divide(merged[numerator], merged[denominator], out=expected, - where=merged[denominator] != 0) + np.divide( + merged[numerator], + merged[denominator], + out=expected, + where=merged[denominator] != 0, + ) np.testing.assert_allclose(merged[derived], expected, rtol=1e-12, atol=1e-12) wrong = (runs[0][derived] + runs[1][derived]) / 2 - assert not np.allclose(expected, wrong, rtol=1e-3, atol=1e-6), "case must detect ratio averaging" + assert not np.allclose( + expected, wrong, rtol=1e-3, atol=1e-6 + ), "case must detect ratio averaging" # The actor-output in-memory merge contract must retain the same raw-first rule. merged_output = ActorOutputAMDM(name="merged", belongs_to=actor, simulation=sim) - merged_output.merge_data_from_actor_output(actor.user_output.amdm, - actor.user_output.amdm) + merged_output.merge_data_from_actor_output( + actor.user_output.amdm, actor.user_output.amdm + ) for item in [0, 1, 2]: - np.testing.assert_allclose(merged_output.get_data(item=item), 2 * merged[item], - rtol=1e-12, atol=1e-10) + np.testing.assert_allclose( + merged_output.get_data(item=item), 2 * merged[item], rtol=1e-12, atol=1e-10 + ) for item, index in [("delta", 3), ("gamma", 4)]: - np.testing.assert_allclose(merged_output.get_data(item=item), merged[index], - rtol=1e-12, atol=1e-12) + np.testing.assert_allclose( + merged_output.get_data(item=item), merged[index], rtol=1e-12, atol=1e-12 + ) print("Unequal runs, continued scoring and raw-first output merging passed") utility.test_ok(True) diff --git a/opengate/tests/src/actors/test110_amdm_scoring.py b/opengate/tests/src/actors/test110_amdm_scoring.py index a9dfaab5db..bff1da3f10 100644 --- a/opengate/tests/src/actors/test110_amdm_scoring.py +++ b/opengate/tests/src/actors/test110_amdm_scoring.py @@ -1,35 +1,51 @@ #!/usr/bin/env python3 """Analytical bin scoring, public configuration, geometry and output contract.""" + import itk import numpy as np import opengate as gate from opengate.exception import GateDeprecationError from opengate.tests import utility from test110_amdm_helpers import ( - GAMMA, DELTA, constant_lut, arrays, output_dir, make_sim, - assert_constant_scoring, check_outputs, + GAMMA, + DELTA, + constant_lut, + arrays, + output_dir, + make_sim, + assert_constant_scoring, + check_outputs, ) - if __name__ == "__main__": scored = [] - for coordinate, hit, raw, weight in [("local", "pre", True, 1.0), - ("global", "post", False, 2.0), - (None, "middle", True, 1.0), - ("global", "random", True, 1.0)]: + for coordinate, hit, raw, weight in [ + ("local", "pre", True, 1.0), + ("global", "post", False, 2.0), + (None, "middle", True, 1.0), + ("global", "random", True, 1.0), + ]: directory = output_dir(f"scoring_{coordinate}_{hit}") - sim, actor = make_sim(directory, coordinate=coordinate, hit_type=hit, weight=weight) + sim, actor = make_sim( + directory, coordinate=coordinate, hit_type=hit, weight=weight + ) actor.storeMergingData = raw sim.run(start_new_process=True) total = assert_constant_scoring(actor) check_outputs(sim, actor, samples=80) scored.append(total) - assert actor.user_output.amdm.merged_data.get_data_item_object(0).number_of_samples == 80 + assert ( + actor.user_output.amdm.merged_data.get_data_item_object(0).number_of_samples + == 80 + ) # The same seeded fully-contained beam gives linear scaling with track weight. # Hit position cannot change its total deposit in a grid covering the target. np.testing.assert_allclose(scored[1], 2 * scored[0], rtol=1e-12, atol=1e-9) - sim, actor = make_sim(output_dir("image_coordinates"), - coordinate="attached_to_image", image_volume=True) + sim, actor = make_sim( + output_dir("image_coordinates"), + coordinate="attached_to_image", + image_volume=True, + ) sim.run(start_new_process=True) assert_constant_scoring(actor) check_outputs(sim, actor, samples=80) @@ -75,7 +91,7 @@ directory = output_dir("excluded_" + particle) lut = constant_lut(directory, {1: (GAMMA, DELTA)}) sim, actor = make_sim(directory, lut=lut, particle=particle) - sim.source_manager.sources["ions"].energy.mono = .5 + sim.source_manager.sources["ions"].energy.mono = 0.5 sim.run(start_new_process=True) for array in arrays(actor): assert np.all(array == 0) @@ -85,7 +101,7 @@ lut = directory / "positron_lut.txt" lut.write_text("1 1 2 7 13 .25 .75 0\n1 10 5 11 17 .25 .75 0\n") sim, actor = make_sim(directory, lut=lut, particle="e+") - sim.source_manager.sources["ions"].energy.mono = .5 + sim.source_manager.sources["ions"].energy.mono = 0.5 sim.run(start_new_process=True) assert_constant_scoring(actor, gamma=[5, 11, 17]) # Disk controls do not disable the internal denominators needed by derived views. @@ -95,5 +111,7 @@ sim.run(start_new_process=True) assert_constant_scoring(actor) assert not list(sim.output_dir.glob("*.mhd")) - print("Analytical scoring, zero denominators, metadata and configuration checks passed") + print( + "Analytical scoring, zero denominators, metadata and configuration checks passed" + ) utility.test_ok(True) diff --git a/opengate/tests/src/actors/test110_amdm_supplied_lut.py b/opengate/tests/src/actors/test110_amdm_supplied_lut.py index feda38839d..9a20824560 100644 --- a/opengate/tests/src/actors/test110_amdm_supplied_lut.py +++ b/opengate/tests/src/actors/test110_amdm_supplied_lut.py @@ -1,5 +1,6 @@ #!/usr/bin/env python3 """Supplied-table acceptance, checked against independently recorded transport steps.""" + from pathlib import Path import hashlib import numpy as np @@ -25,19 +26,31 @@ actor.InitializeUserInfo(actor.user_info) for charge in range(1, 11): group = table[table[:, 0] == charge] - queries = [0.0, group[0, 1], (group[0, 1] + group[1, 1]) / 2, - group[-1, 1], group[-1, 1] + 100] + queries = [ + 0.0, + group[0, 1], + (group[0, 1] + group[1, 1]) / 2, + group[-1, 1], + group[-1, 1] + 100, + ] for energy in queries: - expected_lookup = [np.interp(energy, group[:, 1], group[:, c]) - for c in range(2, 22)] - np.testing.assert_allclose(actor.Lookup(charge, energy), expected_lookup, - rtol=1e-13, atol=1e-13) + expected_lookup = [ + np.interp(energy, group[:, 1], group[:, c]) for c in range(2, 22) + ] + np.testing.assert_allclose( + actor.Lookup(charge, energy), expected_lookup, rtol=1e-13, atol=1e-13 + ) # Public PhaseSpaceActor records every step independently of AMDM scoring. audit = sim.add_actor("PhaseSpaceActor", "steps") audit.attached_to = "phantom" audit.steps_to_store = "all" - audit.attributes = ["PDGCode", "PostKineticEnergy", "PreKineticEnergy", - "TotalEnergyDeposit", "Weight"] + audit.attributes = [ + "PDGCode", + "PostKineticEnergy", + "PreKineticEnergy", + "TotalEnergyDeposit", + "Weight", + ] audit.output_filename = "steps.root" sim.run(start_new_process=True) steps = uproot.open(audit.get_output_path())["steps"].arrays(library="numpy") @@ -49,20 +62,29 @@ assert mask.any() and np.all(code[positive] == 1000060120), np.unique(code) energies = steps["PostKineticEnergy"][mask] / 12.0 weights = steps["TotalEnergyDeposit"][mask] * steps["Weight"][mask] - assert weights.sum() > 0 and np.ptp(energies) > 1, "must exercise energy-dependent lookup" + assert ( + weights.sum() > 0 and np.ptp(energies) > 1 + ), "must exercise energy-dependent lookup" group = table[table[:, 0] == 6] - expected = np.column_stack([np.interp(energies, group[:, 1], group[:, c]) - for c in range(2, 22)]) + expected = np.column_stack( + [np.interp(energies, group[:, 1], group[:, c]) for c in range(2, 22)] + ) expected_delta = (expected[:, 10:] * weights[:, None]).sum(axis=0) - expected_gamma = (expected[:, :10] * expected[:, 10:] * weights[:, None]).sum(axis=0) + expected_gamma = (expected[:, :10] * expected[:, 10:] * weights[:, None]).sum( + axis=0 + ) energy, raw_delta, raw_gamma, delta, gamma = arrays(actor) # Independent step recording, unit conversion and np.interp oracle: allow # only floating-point summation order error, not Monte Carlo disagreement. np.testing.assert_allclose(energy.sum(), weights.sum(), rtol=1e-11, atol=1e-8) - np.testing.assert_allclose(raw_delta.sum(axis=(1, 2, 3)), expected_delta, rtol=1e-11, atol=1e-8) - np.testing.assert_allclose(raw_gamma.sum(axis=(1, 2, 3)), expected_gamma, rtol=1e-11, atol=1e-8) + np.testing.assert_allclose( + raw_delta.sum(axis=(1, 2, 3)), expected_delta, rtol=1e-11, atol=1e-8 + ) + np.testing.assert_allclose( + raw_gamma.sum(axis=(1, 2, 3)), expected_gamma, rtol=1e-11, atol=1e-8 + ) scored = energy > 0 - np.testing.assert_allclose(delta[:, scored].sum(axis=0), 1., rtol=0, atol=1e-12) + np.testing.assert_allclose(delta[:, scored].sum(axis=0), 1.0, rtol=0, atol=1e-12) assert np.all(delta >= 0) and np.all(delta <= 1 + 1e-12) assert np.all(gamma >= 0) and np.isfinite(gamma).all() assert np.all(delta[:, ~scored] == 0) and np.all(gamma[:, ~scored] == 0) diff --git a/opengate/tests/src/actors/test110_amdm_threads.py b/opengate/tests/src/actors/test110_amdm_threads.py index 20537e9b2d..8ba2f04277 100644 --- a/opengate/tests/src/actors/test110_amdm_threads.py +++ b/opengate/tests/src/actors/test110_amdm_threads.py @@ -1,20 +1,27 @@ #!/usr/bin/env python3 """Scientifically relevant ST/MT aggregates and exact constant-bin identities.""" + import numpy as np from opengate.tests import utility -from test110_amdm_helpers import output_dir, make_sim, assert_constant_scoring, check_outputs - +from test110_amdm_helpers import ( + output_dir, + make_sim, + assert_constant_scoring, + check_outputs, +) if __name__ == "__main__": totals = [] for threads in [1, 2]: - sim, actor = make_sim(output_dir(f"threads_{threads}"), threads=threads, primaries=400) + sim, actor = make_sim( + output_dir(f"threads_{threads}"), threads=threads, primaries=400 + ) sim.run(start_new_process=True) totals.append(assert_constant_scoring(actor)) check_outputs(sim, actor, samples=400) # Different thread scheduling uses different random streams. The small fully # contained beam has almost deterministic total deposition; 2% allows its # transport fluctuations while exposing lost/raced updates or duplicated events. - np.testing.assert_allclose(totals[1], totals[0], rtol=.02, atol=0) + np.testing.assert_allclose(totals[1], totals[0], rtol=0.02, atol=0) print("ST/MT weighted energy totals", totals) utility.test_ok(True) diff --git a/simulation.json b/simulation.json index a8e7d50099..76aac56865 100644 --- a/simulation.json +++ b/simulation.json @@ -1,573 +1,573 @@ { + "user_info": { + "verbose_level": "INFO", + "log_sink": null, + "verbose_close": false, + "verbose_getstate": false, + "running_verbose_level": 0, + "g4_verbose_level": 1, + "g4_verbose": false, + "g4_verbose_level_tracking": -1, + "visu": false, + "visu_type": "vrml", + "visu_filename": null, + "visu_verbose": false, + "visu_commands": [ + "# default visualization", + "#/vis/open OGLSQt", + "/vis/open OGLIQt", + "/vis/scene/create", + "/vis/drawVolume worlds", + 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"source_manager" }, - "source_manager": { + "object_type": "SourceManager", + "object_type_full": "", + "class_module": "opengate.managers", + "i_am_a_gate_object": true, + "sources": { + "mysource": { "user_info": { - "name": "source_manager" + "particle": "gamma", + "ion": { + "Z": 0, + "A": 0, + "E": 0 + }, + "weight": -1, + "weight_sigma": -1, + "user_particle_life_time": -1, + "tac_times": null, + "tac_activities": null, + "direction_relative_to_attached_volume": false, + "position": { + "type": "sphere", + "radius": 10.0, + "sigma_x": 0, + "sigma_y": 0, + "size": [ + 0, + 0, + 0 + ], + "translation": [ + 0, + 0, + 0 + ], + "rotation": { + "__ndarray__": [ + [ + 1.0, + 0.0, + 0.0 + ], + [ + 0.0, + 1.0, + 0.0 + ], + [ + 0.0, + 0.0, + 1.0 + ] + ], + "__dtype__": "float64", + "__shape__": [ + 3, + 3 + ] + }, + "confine": null, + "dz": null + }, + "direction": { + "type": "iso", + "theta": [ + 0, + 3.141592653589793 + ], + "phi": [ + 0, + 6.283185307179586 + ], + "momentum": [ + 0, + 0, + 1 + ], + "focus_point": [ + 0, + 0, + 0 + ], + "sigma": [ + 0, + 0 + ], + "angular_acceptance": { + "policy": null, + "skip_policy": "SkipEvents", + "max_rejection": 10000, + "target_volumes": [], + "enable_intersection_check": false, + "enable_angle_check": false, + "angle_check_reference_vector": [ + 0, + 0, + 1 + ], + "angle_check_proximity_distance": 0.0, + "angle_tolerance_proximal": 1.5707963267948966, + "angle_tolerance_min": 0.0, + "angle_tolerance_max": 0.10471975511965978 + }, + "accolinearity_flag": false, + "accolinearity_fwhm": 0.008726646259971648, + "histogram_theta_weights": [], + "histogram_theta_angles": [], + "histogram_phi_weights": [], + "histogram_phi_angles": [] + }, + "energy": { + "type": "mono", + "mono": 1.0, + "sigma_gauss": 0, + "is_cdf": false, + "min_energy": null, + "max_energy": null, + "spectrum_type": null, + "spectrum_weights": [], + "spectrum_energies": [], + "histogram_weight": [], + "histogram_energy": [], + "spectrum_energy_bin_edges": [], + "spectrum_histogram_interpolation": null + }, + "polarization": [], + "visualization": { + "count": 2000, + "color": "yellow", + "size": 2 + }, + "attached_to": "world", + "mother": null, + "start_time": 0.0, + "end_time": 1000000000.0, + "number_of_primaries": { + "__ndarray__": [ + 2 + ], + "__dtype__": "int64", + "__shape__": [ + 1 + ] + }, + "n": 0, + "activity": 0, + "half_life": -1, + "dynamic_params": null, + "name": "mysource" }, - "object_type": "SourceManager", - "object_type_full": "", - "class_module": "opengate.managers", - "i_am_a_gate_object": true, - "sources": { - "mysource": { - "user_info": { - "particle": "gamma", - "ion": { - "Z": 0, - "A": 0, - "E": 0 - }, - "weight": -1, - "weight_sigma": -1, - "user_particle_life_time": -1, - "tac_times": null, - "tac_activities": null, - "direction_relative_to_attached_volume": false, - "position": { - "type": "sphere", - "radius": 10.0, - "sigma_x": 0, - "sigma_y": 0, - "size": [ - 0, - 0, - 0 - ], - "translation": [ - 0, - 0, - 0 - ], - "rotation": { - "__ndarray__": [ - [ - 1.0, - 0.0, - 0.0 - ], - [ - 0.0, - 1.0, - 0.0 - ], - [ - 0.0, - 0.0, - 1.0 - ] - ], - "__dtype__": "float64", - "__shape__": [ - 3, - 3 - ] - }, - "confine": null, - "dz": null - }, - "direction": { - "type": "iso", - "theta": [ - 0, - 3.141592653589793 - ], - "phi": [ - 0, - 6.283185307179586 - ], - "momentum": [ - 0, - 0, - 1 - ], - "focus_point": [ - 0, - 0, - 0 - ], - "sigma": [ - 0, - 0 - ], - "angular_acceptance": { - "policy": null, - "skip_policy": "SkipEvents", - "max_rejection": 10000, - "target_volumes": [], - "enable_intersection_check": false, - "enable_angle_check": false, - "angle_check_reference_vector": [ - 0, - 0, - 1 - ], - "angle_check_proximity_distance": 0.0, - "angle_tolerance_proximal": 1.5707963267948966, - "angle_tolerance_min": 0.0, - "angle_tolerance_max": 0.10471975511965978 - }, - "accolinearity_flag": false, - "accolinearity_fwhm": 0.008726646259971648, - "histogram_theta_weights": [], - "histogram_theta_angles": [], - "histogram_phi_weights": [], - "histogram_phi_angles": [] - }, - "energy": { - "type": "mono", - "mono": 1.0, - "sigma_gauss": 0, - "is_cdf": false, - "min_energy": null, - "max_energy": null, - "spectrum_type": null, - "spectrum_weights": [], - "spectrum_energies": [], - "histogram_weight": [], - "histogram_energy": [], - "spectrum_energy_bin_edges": [], - "spectrum_histogram_interpolation": null - }, - "polarization": [], - "visualization": { - "count": 2000, - "color": "yellow", - "size": 2 - }, - "attached_to": "world", - "mother": null, - "start_time": 0.0, - "end_time": 1000000000.0, - "number_of_primaries": { - "__ndarray__": [ - 2 - ], - "__dtype__": "int64", - "__shape__": [ - 1 - ] - }, - "n": 0, - "activity": 0, - "half_life": -1, - "dynamic_params": null, - "name": "mysource" - }, - "object_type": "GenericSource", - "object_type_full": "", - "class_module": "opengate.sources.generic", - "i_am_a_gate_object": true - } - } - }, - "auxiliary_attributes": {} + "object_type": "GenericSource", + "object_type_full": "", + "class_module": "opengate.sources.generic", + "i_am_a_gate_object": true + } + } + }, + "auxiliary_attributes": {} } \ No newline at end of file From b67debe021f57406a45636935e96947e24b166b2 Mon Sep 17 00:00:00 2001 From: Hermann Fuchs Date: Fri, 2 Oct 2026 14:47:15 +0200 Subject: [PATCH 3/4] changed naming of tests and improved documentation --- .../opengate_lib/GateAMDMActor.cpp | 3 + .../opengate_lib/GateAMDMActor.h | 12 +++ .../GateAMDMActor_lookUpTable.cpp | 2 + .../opengate_lib/GateAMDMActor_lookUpTable.hh | 10 +- .../opengate_lib/pyGateAMDMActor.cpp | 24 +++-- .../user_guide/user_guide_amdm_actor.rst | 101 ++++++++++++------ opengate/actors/amdmoutput.py | 22 ++++ opengate/actors/doseactors.py | 23 ++++ .../tests/src/actors/test110_amdm_helpers.py | 24 +++++ opengate/tests/src/actors/test110_amdm_lut.py | 1 + 10 files changed, 184 insertions(+), 38 deletions(-) diff --git a/core/opengate_core/opengate_lib/GateAMDMActor.cpp b/core/opengate_core/opengate_lib/GateAMDMActor.cpp index e44b6c17f2..3d0dbc0f79 100644 --- a/core/opengate_core/opengate_lib/GateAMDMActor.cpp +++ b/core/opengate_core/opengate_lib/GateAMDMActor.cpp @@ -110,6 +110,7 @@ void GateAMDMActor::SteppingAction(G4Step *step) { if (charge <= 0) return; const int mass = track->GetDefinition()->GetBaryonNumber(); + // GetKineticEnergy is the track's post-step sample at this scoring callback. const double kineticEnergy = track->GetKineticEnergy() / CLHEP::MeV; // Preserve legacy applicability, including its zero-baryon rule: positive // energy / 0 samples the upper endpoint; 0 / 0 contributes nothing. @@ -128,6 +129,8 @@ void GateAMDMActor::SteppingAction(G4Step *step) { // One actor-owned lock protects all shared accumulator updates. std::lock_guard lock(fScoringMutex); ImageAddValue(cpp_amdm_restricted_edep_image, index, edep); + // LUT values are gamma[0..bins) followed by delta[0..bins). + // Keep both numerators raw; Python derives ratios only after worker scoring. for (int b = 0; b < fBins; ++b) { index4[3] = b; const double delta = values[fBins + b] * edep; diff --git a/core/opengate_core/opengate_lib/GateAMDMActor.h b/core/opengate_core/opengate_lib/GateAMDMActor.h index cf90f60e1b..395ec181a8 100644 --- a/core/opengate_core/opengate_lib/GateAMDMActor.h +++ b/core/opengate_core/opengate_lib/GateAMDMActor.h @@ -12,18 +12,30 @@ #include #include +/** Score weighted AMDM raw sums on a shared spatial grid with a separate bin axis. */ class GateAMDMActor : public GateVActor { public: using ImageType = itk::Image; using ImageType4D = itk::Image; + /** Construct an MT-capable actor from the current Python user-info dictionary. */ explicit GateAMDMActor(py::dict &user_info); + /** Read voxel settings and validate/load the charge-energy LUT before scoring. */ void InitializeUserInfo(py::dict &user_info) override; + /** Initialize the base actor and create the 3D/4D ITK image holders. */ void InitializeCpp() override; + /** Reset the event count and attach fresh buffers to the current volume pose. */ void BeginOfRunActionMasterThread(int run_id) override; + /** Count an event under the same actor-owned lock used for worker scoring. */ void BeginOfEventAction(const G4Event *) override; + /** Accumulate a step's weighted MeV, delta*MeV and gamma*delta*MeV raw sums. */ void SteppingAction(G4Step *) override; + /** Return the physical-volume name used for run-time geometry attachment. */ std::string GetPhysicalVolumeName() const { return fPhysicalVolumeName; } + /** Select the resolved physical volume, including an inherited copy index. */ void SetPhysicalVolumeName(std::string name) { fPhysicalVolumeName = name; } + /** Return gamma bins then delta bins for charge and energy in MeV/n. + * Missing charges and NaN energies return an empty vector; endpoints clamp. + */ std::vector Lookup(int charge, double energy) const; ImageType::Pointer cpp_amdm_restricted_edep_image; diff --git a/core/opengate_core/opengate_lib/GateAMDMActor_lookUpTable.cpp b/core/opengate_core/opengate_lib/GateAMDMActor_lookUpTable.cpp index b6b068c793..8d8841dcac 100644 --- a/core/opengate_core/opengate_lib/GateAMDMActor_lookUpTable.cpp +++ b/core/opengate_core/opengate_lib/GateAMDMActor_lookUpTable.cpp @@ -13,6 +13,7 @@ void GateAMDMLookUpTable::Read(const std::string &filename, int bins) { std::ifstream input(filename); if (!input) throw std::invalid_argument("AMDM cannot open LUT: " + filename); + // Parse transactionally: failed reinitialization must not leave a partial LUT. std::map> data; std::string line; int previousCharge = 0; @@ -23,6 +24,7 @@ void GateAMDMLookUpTable::Read(const std::string &filename, int bins) { std::istringstream stream(line); std::vector columns; std::string token; + // Include the original input line in every validation error. auto fail = [&](const std::string &reason) { throw std::invalid_argument("AMDM LUT " + filename + ":" + std::to_string(lineNumber) + ": " + reason); diff --git a/core/opengate_core/opengate_lib/GateAMDMActor_lookUpTable.hh b/core/opengate_core/opengate_lib/GateAMDMActor_lookUpTable.hh index b7a74e4fa7..d0bc415ff0 100644 --- a/core/opengate_core/opengate_lib/GateAMDMActor_lookUpTable.hh +++ b/core/opengate_core/opengate_lib/GateAMDMActor_lookUpTable.hh @@ -6,10 +6,18 @@ #include #include -// Immutable after loading. Each charge has its own energy grid and endpoints. +/** Immutable during scoring; each charge owns its energy grid and endpoints. */ class GateAMDMLookUpTable { public: + /** Load a whitespace/comment table with 2 + 2*bins finite columns per row. + * Validate positive keys and ordered unique energy grids. Raise + * std::invalid_argument on malformed/unreadable input and retain old data. + */ void Read(const std::string &filename, int bins); + /** Fill values with gamma bins followed by delta bins at energy in MeV/n. + * Interpolate linearly within a group and clamp at its endpoints. Return + * false and clear values for a missing charge or NaN energy; infinities clamp. + */ bool Find(int charge, double energy, std::vector &values) const; private: diff --git a/core/opengate_core/opengate_lib/pyGateAMDMActor.cpp b/core/opengate_core/opengate_lib/pyGateAMDMActor.cpp index 49ffdd59cc..6ce00944ff 100644 --- a/core/opengate_core/opengate_lib/pyGateAMDMActor.cpp +++ b/core/opengate_core/opengate_lib/pyGateAMDMActor.cpp @@ -3,27 +3,33 @@ #include #include +/** Forward master callbacks to the Python wrapper that owns the output lifecycle. */ class PyGateAMDMActor : public GateAMDMActor { public: using GateAMDMActor::GateAMDMActor; + /** Dispatch run allocation/attachment to a Python override when present. */ void BeginOfRunActionMasterThread(int run_id) override { PYBIND11_OVERLOAD(void, GateAMDMActor, BeginOfRunActionMasterThread, run_id); } + /** Dispatch completed-run copying/merging to a Python override when present. */ int EndOfRunActionMasterThread(int run_id) override { PYBIND11_OVERLOAD(int, GateAMDMActor, EndOfRunActionMasterThread, run_id); } }; +/** Register the actor, image buffers, master callbacks and lookup inspection API. */ void init_GateAMDMActor(py::module &m) { py::class_, GateVActor>( - m, "GateAMDMActor") - .def(py::init()) + m, "GateAMDMActor", "C++ AMDM scorer with thread-safe raw image accumulation.") + .def(py::init(), "Construct the scorer from Python user information.") .def("BeginOfRunActionMasterThread", - &GateAMDMActor::BeginOfRunActionMasterThread) + &GateAMDMActor::BeginOfRunActionMasterThread, + "Reset event counts and attach fresh raw images to the current volume pose.") .def("EndOfRunActionMasterThread", - &GateAMDMActor::EndOfRunActionMasterThread) + &GateAMDMActor::EndOfRunActionMasterThread, + "Complete a master-thread run; Python overrides copy and merge raw outputs.") .def_readwrite("cpp_amdm_restricted_edep_image", &GateAMDMActor::cpp_amdm_restricted_edep_image) .def_readwrite("cpp_amdm_delta_image", @@ -32,7 +38,11 @@ void init_GateAMDMActor(py::module &m) { &GateAMDMActor::cpp_amdm_gamma_image) .def_readonly("NbOfEvent", &GateAMDMActor::NbOfEvent) .def("Lookup", &GateAMDMActor::Lookup, py::arg("charge"), - py::arg("energy")) - .def("GetPhysicalVolumeName", &GateAMDMActor::GetPhysicalVolumeName) - .def("SetPhysicalVolumeName", &GateAMDMActor::SetPhysicalVolumeName); + py::arg("energy"), + "Return interpolated gamma then delta bins for charge and energy in MeV/n; " + "clamp endpoints and return an empty list for missing charges or NaN.") + .def("GetPhysicalVolumeName", &GateAMDMActor::GetPhysicalVolumeName, + "Return the resolved physical-volume name used for scoring-grid attachment.") + .def("SetPhysicalVolumeName", &GateAMDMActor::SetPhysicalVolumeName, + "Set the resolved physical-volume name used for scoring-grid attachment."); } diff --git a/docs/source/user_guide/user_guide_amdm_actor.rst b/docs/source/user_guide/user_guide_amdm_actor.rst index 7a5e0eeeb1..9742dbcd9b 100644 --- a/docs/source/user_guide/user_guide_amdm_actor.rst +++ b/docs/source/user_guide/user_guide_amdm_actor.rst @@ -8,9 +8,6 @@ grid. Gamma (also called yd in the table) is expressed in keV/µm; delta is dimensionless. The actor uses the material and particle transport of the simulation without changing the physics model. -Discussion ----------- - The abridged microdosimetric distribution methodology (AMDM) was published by Parisi, Beltran and Furutani in `10.1002/acm2.14049 `_. It was subsequently used in OpenGATE10 @@ -179,8 +176,23 @@ retention to keep results. Set ``keep_data_in_memory=False`` to release the outputs at simulation close; use the files thereafter. Set output filenames to None or an empty string only with the corresponding disk writes disabled. -Lookup and scoring ------------------- +AMDM_LUT.txt +------------ + +``LUTfilename`` selects a user-supplied plain-text lookup table. The name +``AMDM_LUT.txt`` is the default relative filename; it does not identify an +automatically deployed table. The development copy used by the acceptance test +is ``opengate/tests/src/actors/fixtures/test110_amdm/AMDM_LUT.txt``. Production +studies supply their own table and explicitly configure its path. + +File format +~~~~~~~~~~~ + +Each data row describes one particle charge and kinetic energy per nucleon: + +.. code-block:: text + + charge energy_MeV_per_nucleon gamma_1 ... gamma_N delta_1 ... delta_N The LUT has two key columns (positive integral charge and positive energy in MeV/n), then one gamma/yd column per bin in keV/µm, then one dimensionless delta @@ -188,13 +200,65 @@ column per bin. All entries must be finite numbers. Charge groups must be ordered; energy keys must be unique and strictly increasing within each group. Groups may have different sizes and energy ranges, including a single entry. Blank lines, whitespace, and comments starting with ``#`` are accepted. -Validation checks the schema; it does not require a particular gamma/delta -model or force the delta values to sum to one. +For N bins, every row must contain exactly ``2 + 2*N`` numeric values and +``AMDM_Bins`` must equal N. For example, this artificial two-bin table illustrates +the format, not a physically calculated LUT: + +.. code-block:: text + + # charge E[MeV/n] gamma1[keV/um] gamma2[keV/um] delta1 delta2 + 6 1 2 7 0.25 0.75 + 6 10 3 9 0.20 0.80 + +The reader checks the schema but does not enforce nonnegative gamma/delta +values or a unit sum of delta. Store the bin edges, microscopic scoring-site +geometry/material, particle/isotope assumptions and spectrum-generation method +alongside the table; these are not encoded in its numeric columns. Charge is +the only species key, so the table cannot distinguish isotopes sharing a charge. Bin values interpolate linearly in energy within the particle's charge group. Values below/above its energy range clamp to that group's first/last row. Missing charges contribute neither to the restricted energy nor to the bins. +Calculating a table +~~~~~~~~~~~~~~~~~~~ + +For each charge and energy key, obtain a microdosimetric lineal-energy spectrum +for the chosen material and microscopic scoring site using a suitable +microdosimetric calculation, such as the PHITS microdosimetric function used in +the published methodology. Choose the same lineal-energy bin edges for every +row. The actor consumes these precomputed spectra summaries; this port does not +include a spectrum simulator or an automatic LUT generator. + +Let ``d(y)`` be the dose probability density, normalized so its integral is one, +and let ``[y_low, y_high)`` be a bin, with y in keV/µm. Calculate the two entries +using Equations 6 and 7 of `Parisi et al. +`_: + +.. math:: + + \delta_b = \int_{y_{b,\mathrm{low}}}^{y_{b,\mathrm{high}}} d(y)\,dy, + \qquad + \gamma_b = + \frac{\int_{y_{b,\mathrm{low}}}^{y_{b,\mathrm{high}}} y\,d(y)\,dy} + {\delta_b}. + +For a dose histogram, sum its dose weights within each AMDM bin: delta is that +sum divided by the total dose weight, and gamma is the dose-weighted mean y +within the bin. If the input is a probability *density*, include histogram +widths in the sums. If it is a frequency spectrum, convert it to a dose spectrum +by weighting with y and normalizing first. Write zero gamma for an empty bin +to keep every entry finite. Gamma is a calculated mean, not the bin midpoint. + +Check nonnegative values, delta sums near one when bins cover the full spectrum, +gamma within its bin, statistical convergence and interpolation accuracy. +Cover the expected particle charges and energy range, then write rows ordered +by charge and energy, with all gamma values before all delta values. Endpoint +clamping and missing-charge exclusion make adequate table coverage necessary. + +Lookup and scoring +------------------ + For compatibility with the source actor, the LUT query uses the track's kinetic energy at the scoring callback (post-step energy), divided by its baryon number. It does not use mean pre/post energy. Track weight multiplies the deposited @@ -276,27 +340,4 @@ the volume, following current actor conventions. A merged global image has the first contributing run's coordinates; it is not a resampling of all runs into a fixed world grid. Retain per-run outputs to inspect their individual poses. -Validation and migration ------------------------- - -Use ``sim.add_actor("AMDMActor", "amdm")`` and ``attached_to``. Replace obsolete -``output`` with ``output_filename`` and ``sim.output_dir``. Initialization and -callbacks use the current framework; wrong fluence references, duplicate LUT -allocation, unchecked endpoint iterators, process-exit errors and destructive -normalization were repaired. Zero denominators now explicitly yield zero. - -Tests in ``tests/src/actors/test110_amdm_*.py`` exercise independently known -constant-bin results, interpolation and malformed tables, full output headers -and payloads, zero bins, coordinates, track weights, unequal run contributions, -raw-first merging and single/multithread aggregates. The supplied-LUT test uses -the development fixture ``tests/src/actors/fixtures/test110_amdm/AMDM_LUT.txt`` -with SHA-256 -``93d42113b9f48e3ec069000f5983e4568f7bca2e873d1cb06186d08f949771ab``; -it compares the ten raw bins to independently recorded PhaseSpaceActor steps -and NumPy interpolation. This is analytical/transport-step acceptance evidence. -No independently trusted legacy output image was found for a legacy numerical -comparison. The fixture is a test input, not a generated output reference or a -production LUT selected automatically by the actor. The original root-level -development file is not required to run the tests. - .. autoclass:: opengate.actors.doseactors.AMDMActor diff --git a/opengate/actors/amdmoutput.py b/opengate/actors/amdmoutput.py index 7ad7e2b691..e751043d82 100644 --- a/opengate/actors/amdmoutput.py +++ b/opengate/actors/amdmoutput.py @@ -17,17 +17,27 @@ class AMDMImageContainer(ImageDataItemContainerMixin, DataItemContainer): + """Store raw 3D/4D sums and expose normalized images without changing them.""" + # Persist and merge only raw sums. Derived views never mutate those sums. _data_item_classes = (ItkImageDataItem,) * 3 primary_item_identifiers = (0, 1, 2) # restricted MeV, raw delta, raw gamma def _ratio(self, numerator, denominator): + """Return a scalar double ratio image, using zero for zero denominators. + + Parameters are primary item identifiers. A 3D denominator broadcasts + over the numerator's leading bin axis; metadata follows the numerator. + Missing input data produces an empty data item. + """ n = self.data[numerator] d = self.data[denominator] if n.data_is_none or d.data_is_none: return ItkImageDataItem(data=None) na = itk.array_view_from_image(n.data) da = itk.array_view_from_image(d.data) + # Arrays use [bin, z, y, x], so restricted energy broadcasts over bins. + # Initialize the masked divisions to zero instead of inheriting NaNs. result = np.zeros_like(na) np.divide(na, da, out=result, where=da != 0) image = itk.image_from_array(result, is_vector=False) @@ -38,13 +48,20 @@ def _ratio(self, numerator, denominator): @derived_data_item(depends_on=(0, 1)) def delta(self): + """Return dimensionless bin fractions: raw delta / restricted energy.""" return self._ratio(1, 0) @derived_data_item(depends_on=(1, 2)) def gamma(self): + """Return bin dose-mean lineal energies: raw gamma / raw delta, in keV/µm.""" return self._ratio(2, 1) def set_image_properties(self, item="all", **properties): + """Apply image properties to selected items, retaining the bin axis. + + Expand spatial origin/spacing to 4D with bin origin 0 and spacing 1; + the existing image-item method handles spatial direction expansion. + """ # VoxelDepositActor supplies spatial properties. Keep the bin axis # independent when applying them to the two four-dimensional buffers. for image_item in self._get_image_data_items(item): @@ -72,6 +89,11 @@ class ActorOutputAMDM(ActorOutputImage): } def _insert_item_suffix(self, output_filename, item): + """Resolve an item's legacy MetaImage name from an actor-wide basename. + + Remove only the final extension, retain the parent directory, and + preserve the framework's None, empty and automatic filename markers. + """ if output_filename in (None, "", "auto"): return output_filename path = Path(output_filename) diff --git a/opengate/actors/doseactors.py b/opengate/actors/doseactors.py index 240bce13e8..a110e18c04 100644 --- a/opengate/actors/doseactors.py +++ b/opengate/actors/doseactors.py @@ -2280,10 +2280,12 @@ class AMDMActor(VoxelDepositActor, g4.GateAMDMActor): } def __init__(self, *args, **kwargs): + """Create the voxel actor, output interfaces and C++ scoring instance.""" VoxelDepositActor.__init__(self, *args, **kwargs) self.__initcpp__() def __initcpp__(self): + """Construct C++ state and register AMDM's engine lifecycle callbacks.""" g4.GateAMDMActor.__init__(self, self.user_info) self.AddActions( { @@ -2298,14 +2300,23 @@ def __initcpp__(self): @property def output_filename(self): + """Return the configured normalized-delta filename.""" return self.delta.output_filename @output_filename.setter def output_filename(self, filename): + """Configure all AMDM output filenames from one shared basename.""" # Keep the legacy hyphenated names when setting the actor-wide basename. self.user_output.amdm.set_output_filename(filename, item="all") def initialize(self): + """Validate voxel/LUT parameters and initialize the C++ accumulators. + + Run after the engine resolves volume attachment. Invalid geometry, + bin counts or table inputs raise the framework/C++ validation errors. + Raw file activation follows storeMergingData without changing the + internal sums or explicit write_to_disk settings. + """ VoxelDepositActor.initialize(self) self.check_user_input() if not isinstance(self.attached_to, str): @@ -2350,10 +2361,16 @@ def initialize(self): self.LUTfilename = str(self.LUTfilename) self.InitializeUserInfo(self.user_info) self.InitializeCpp() + # Derived outputs always need raw data, even when raw files are disabled. self.raw_delta.active = self.storeMergingData self.raw_gamma.active = self.storeMergingData def BeginOfRunActionMasterThread(self, run_index): + """Allocate zero raw buffers and attach the scoring grid for this run. + + run_index identifies the framework run. This master callback precedes + worker scoring and repeats allocation/attachment for each interval. + """ from ..image import create_3d_image, create_4d_image images = [create_3d_image(self.size, self.spacing, pixel_type="double")] @@ -2373,6 +2390,12 @@ def BeginOfRunActionMasterThread(self, run_index): g4.GateAMDMActor.BeginOfRunActionMasterThread(self, run_index) def EndOfRunActionMasterThread(self, run_index): + """Copy completed raw buffers, set metadata, and merge the run output. + + Workers have finished before this callback. Copies keep retained runs + independent of the next run's buffers; normalization stays deferred + to the output container. Return the inherited callback result. + """ self.user_output.amdm.store_data( run_index, *( diff --git a/opengate/tests/src/actors/test110_amdm_helpers.py b/opengate/tests/src/actors/test110_amdm_helpers.py index 98fb908f49..8a318cef0d 100644 --- a/opengate/tests/src/actors/test110_amdm_helpers.py +++ b/opengate/tests/src/actors/test110_amdm_helpers.py @@ -16,6 +16,7 @@ def output_dir(name): + """Create a named AMDM test output directory without changing reference data.""" paths = utility.get_default_test_paths(__file__) path = paths.output / "test110_amdm" / name path.mkdir(parents=True, exist_ok=True) @@ -23,6 +24,11 @@ def output_dir(name): def constant_lut(directory, entries=None): + """Write a synthetic constant three-bin LUT with two energy keys per charge. + + entries maps charge to (gamma, delta) arrays; omitted entries use the + distinct carbon-bin constants, including a zero-dose third bin. + """ if entries is None: entries = {6: (GAMMA, DELTA)} path = Path(directory) / "synthetic_lut.txt" @@ -47,6 +53,12 @@ def make_sim( primaries=80, image_volume=False, ): + """Build a small fixed-seed ion simulation and return (simulation, AMDM actor). + + Use a rotated, translated water target and scoring grid to exercise spatial + metadata. Optional settings select weights, threads, coordinate/hit modes, + particle/run contributions, or a generated native ImageVolume fixture. + """ directory = Path(directory) sim = gate.Simulation() sim.output_dir = directory @@ -100,6 +112,7 @@ def make_sim( def arrays(actor, which="merged"): + """Copy energy, raw delta/gamma and normalized delta/gamma arrays for a run.""" return tuple( itk.array_from_image(interface.get_data(which=which)) for interface in ( @@ -113,6 +126,7 @@ def arrays(actor, which="merged"): def expected_metadata(sim, actor): + """Calculate spatial origin/direction independently for the selected frame.""" center = -(np.asarray(actor.size) - 1) * np.asarray(actor.spacing) / 2 origin = actor.rotation @ center + actor.translation direction = actor.rotation @@ -182,6 +196,11 @@ def check_image(path, dimension, actor, origin, direction, samples=None): def check_outputs(sim, actor, which="merged", samples=None): + """Assert enabled image contents/names/metadata and disabled file absence. + + Return arrays read from enabled files for the merged output or run index. + Check sample sidecars when the expected event count is provided. + """ origin, direction = expected_metadata(sim, actor) result = [] for interface, dimension, suffix in [ @@ -209,6 +228,11 @@ def check_outputs(sim, actor, which="merged", samples=None): def assert_constant_scoring(actor, gamma=GAMMA, delta=DELTA): + """Assert constant-bin raw/normalized identities and return restricted MeV. + + Require both scored and empty voxels and verify zero-denominator results. + Tolerances allow accumulation roundoff only, not stochastic disagreement. + """ energy, raw_delta, raw_gamma, normalized_delta, normalized_gamma = arrays(actor) assert energy.sum() > 0, "simulation must score nonzero restricted energy" assert np.any(energy == 0), "test must include empty voxels" diff --git a/opengate/tests/src/actors/test110_amdm_lut.py b/opengate/tests/src/actors/test110_amdm_lut.py index 1f7cad5ed3..b2502ecfa4 100644 --- a/opengate/tests/src/actors/test110_amdm_lut.py +++ b/opengate/tests/src/actors/test110_amdm_lut.py @@ -12,6 +12,7 @@ def lookup_actor(path, bins=2): + """Construct a public AMDM actor and load a LUT without starting transport.""" sim = gate.Simulation() actor = sim.add_actor("AMDMActor", "lookup") actor.AMDM_Bins = bins From 220e59b958364fdd4184057408b79df73599718d Mon Sep 17 00:00:00 2001 From: "pre-commit-ci[bot]" <66853113+pre-commit-ci[bot]@users.noreply.github.com> Date: Fri, 2 Oct 2026 12:54:33 +0000 Subject: [PATCH 4/4] [pre-commit.ci] Automatic python and c++ formatting --- .../opengate_lib/GateAMDMActor.h | 15 ++++++--- .../GateAMDMActor_lookUpTable.cpp | 3 +- .../opengate_lib/GateAMDMActor_lookUpTable.hh | 3 +- .../opengate_lib/pyGateAMDMActor.cpp | 33 ++++++++++++------- 4 files changed, 36 insertions(+), 18 deletions(-) diff --git a/core/opengate_core/opengate_lib/GateAMDMActor.h b/core/opengate_core/opengate_lib/GateAMDMActor.h index 395ec181a8..a5f5477fa5 100644 --- a/core/opengate_core/opengate_lib/GateAMDMActor.h +++ b/core/opengate_core/opengate_lib/GateAMDMActor.h @@ -12,22 +12,27 @@ #include #include -/** Score weighted AMDM raw sums on a shared spatial grid with a separate bin axis. */ +/** Score weighted AMDM raw sums on a shared spatial grid with a separate bin + * axis. */ class GateAMDMActor : public GateVActor { public: using ImageType = itk::Image; using ImageType4D = itk::Image; - /** Construct an MT-capable actor from the current Python user-info dictionary. */ + /** Construct an MT-capable actor from the current Python user-info + * dictionary. */ explicit GateAMDMActor(py::dict &user_info); - /** Read voxel settings and validate/load the charge-energy LUT before scoring. */ + /** Read voxel settings and validate/load the charge-energy LUT before + * scoring. */ void InitializeUserInfo(py::dict &user_info) override; /** Initialize the base actor and create the 3D/4D ITK image holders. */ void InitializeCpp() override; - /** Reset the event count and attach fresh buffers to the current volume pose. */ + /** Reset the event count and attach fresh buffers to the current volume pose. + */ void BeginOfRunActionMasterThread(int run_id) override; /** Count an event under the same actor-owned lock used for worker scoring. */ void BeginOfEventAction(const G4Event *) override; - /** Accumulate a step's weighted MeV, delta*MeV and gamma*delta*MeV raw sums. */ + /** Accumulate a step's weighted MeV, delta*MeV and gamma*delta*MeV raw sums. + */ void SteppingAction(G4Step *) override; /** Return the physical-volume name used for run-time geometry attachment. */ std::string GetPhysicalVolumeName() const { return fPhysicalVolumeName; } diff --git a/core/opengate_core/opengate_lib/GateAMDMActor_lookUpTable.cpp b/core/opengate_core/opengate_lib/GateAMDMActor_lookUpTable.cpp index 8d8841dcac..cc183cd9d3 100644 --- a/core/opengate_core/opengate_lib/GateAMDMActor_lookUpTable.cpp +++ b/core/opengate_core/opengate_lib/GateAMDMActor_lookUpTable.cpp @@ -13,7 +13,8 @@ void GateAMDMLookUpTable::Read(const std::string &filename, int bins) { std::ifstream input(filename); if (!input) throw std::invalid_argument("AMDM cannot open LUT: " + filename); - // Parse transactionally: failed reinitialization must not leave a partial LUT. + // Parse transactionally: failed reinitialization must not leave a partial + // LUT. std::map> data; std::string line; int previousCharge = 0; diff --git a/core/opengate_core/opengate_lib/GateAMDMActor_lookUpTable.hh b/core/opengate_core/opengate_lib/GateAMDMActor_lookUpTable.hh index d0bc415ff0..6657d6b940 100644 --- a/core/opengate_core/opengate_lib/GateAMDMActor_lookUpTable.hh +++ b/core/opengate_core/opengate_lib/GateAMDMActor_lookUpTable.hh @@ -16,7 +16,8 @@ public: void Read(const std::string &filename, int bins); /** Fill values with gamma bins followed by delta bins at energy in MeV/n. * Interpolate linearly within a group and clamp at its endpoints. Return - * false and clear values for a missing charge or NaN energy; infinities clamp. + * false and clear values for a missing charge or NaN energy; infinities + * clamp. */ bool Find(int charge, double energy, std::vector &values) const; diff --git a/core/opengate_core/opengate_lib/pyGateAMDMActor.cpp b/core/opengate_core/opengate_lib/pyGateAMDMActor.cpp index 6ce00944ff..ec93a7e7d7 100644 --- a/core/opengate_core/opengate_lib/pyGateAMDMActor.cpp +++ b/core/opengate_core/opengate_lib/pyGateAMDMActor.cpp @@ -3,7 +3,8 @@ #include #include -/** Forward master callbacks to the Python wrapper that owns the output lifecycle. */ +/** Forward master callbacks to the Python wrapper that owns the output + * lifecycle. */ class PyGateAMDMActor : public GateAMDMActor { public: using GateAMDMActor::GateAMDMActor; @@ -12,24 +13,30 @@ class PyGateAMDMActor : public GateAMDMActor { PYBIND11_OVERLOAD(void, GateAMDMActor, BeginOfRunActionMasterThread, run_id); } - /** Dispatch completed-run copying/merging to a Python override when present. */ + /** Dispatch completed-run copying/merging to a Python override when present. + */ int EndOfRunActionMasterThread(int run_id) override { PYBIND11_OVERLOAD(int, GateAMDMActor, EndOfRunActionMasterThread, run_id); } }; -/** Register the actor, image buffers, master callbacks and lookup inspection API. */ +/** Register the actor, image buffers, master callbacks and lookup inspection + * API. */ void init_GateAMDMActor(py::module &m) { py::class_, GateVActor>( - m, "GateAMDMActor", "C++ AMDM scorer with thread-safe raw image accumulation.") - .def(py::init(), "Construct the scorer from Python user information.") + m, "GateAMDMActor", + "C++ AMDM scorer with thread-safe raw image accumulation.") + .def(py::init(), + "Construct the scorer from Python user information.") .def("BeginOfRunActionMasterThread", &GateAMDMActor::BeginOfRunActionMasterThread, - "Reset event counts and attach fresh raw images to the current volume pose.") + "Reset event counts and attach fresh raw images to the current " + "volume pose.") .def("EndOfRunActionMasterThread", &GateAMDMActor::EndOfRunActionMasterThread, - "Complete a master-thread run; Python overrides copy and merge raw outputs.") + "Complete a master-thread run; Python overrides copy and merge raw " + "outputs.") .def_readwrite("cpp_amdm_restricted_edep_image", &GateAMDMActor::cpp_amdm_restricted_edep_image) .def_readwrite("cpp_amdm_delta_image", @@ -39,10 +46,14 @@ void init_GateAMDMActor(py::module &m) { .def_readonly("NbOfEvent", &GateAMDMActor::NbOfEvent) .def("Lookup", &GateAMDMActor::Lookup, py::arg("charge"), py::arg("energy"), - "Return interpolated gamma then delta bins for charge and energy in MeV/n; " - "clamp endpoints and return an empty list for missing charges or NaN.") + "Return interpolated gamma then delta bins for charge and energy in " + "MeV/n; " + "clamp endpoints and return an empty list for missing charges or " + "NaN.") .def("GetPhysicalVolumeName", &GateAMDMActor::GetPhysicalVolumeName, - "Return the resolved physical-volume name used for scoring-grid attachment.") + "Return the resolved physical-volume name used for scoring-grid " + "attachment.") .def("SetPhysicalVolumeName", &GateAMDMActor::SetPhysicalVolumeName, - "Set the resolved physical-volume name used for scoring-grid attachment."); + "Set the resolved physical-volume name used for scoring-grid " + "attachment."); }