From 7baae301c8c2ca99ca9e80497b2d80d6f5fe2735 Mon Sep 17 00:00:00 2001 From: Adam Moyer Date: Thu, 22 Aug 2019 10:32:16 -0700 Subject: [PATCH] Added simple pip install script --- MANIFEST.in | 2 ++ setup.py | 11 +++++++++++ 2 files changed, 13 insertions(+) create mode 100644 MANIFEST.in create mode 100644 setup.py diff --git a/MANIFEST.in b/MANIFEST.in new file mode 100644 index 0000000..da8b878 --- /dev/null +++ b/MANIFEST.in @@ -0,0 +1,2 @@ +include aimnet/pretrained/aimnet/*.yaml +include aimnet/pretrained/aimnet/*.pt diff --git a/setup.py b/setup.py new file mode 100644 index 0000000..79ffc0a --- /dev/null +++ b/setup.py @@ -0,0 +1,11 @@ +from setuptools import setup + +setup(name='aimnet', + version='0.1', + description='Atoms In Molecules Neural Network Potential', + url='https://github.com/aiqm/aimnet.git', + author='Roman Zubatyuk', + license='MIT', + packages=['aimnet'], + include_package_data=True, + zip_safe=False)