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<!DOCTYPE html>
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<title>Articles & News — MAPLE</title>
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<h1>Articles & News</h1>
<p class="subtitle">Publications and release updates for the MAPLE project.</p>
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<div class="page-body">
<article>
<div class="section-header">
<h2 id="maple-papers">MAPLE Publications</h2>
<p>Papers describing the MAPLE framework and its applications.</p>
</div>
<div class="card-grid">
<a class="card" id="paper-maple" href="https://chemrxiv.org/doi/10.26434/chemrxiv-2026-k7znx" target="_blank" rel="noopener noreferrer">
<div class="card-tag">Framework — January 3, 2026 · ChemRxiv</div>
<h3>MAPLE: A General Framework for Automated Molecular Modeling Across Machine Learning Potentials</h3>
<p>Presents MAPLE as a comprehensive framework for automated molecular modeling that works seamlessly across different machine learning potentials, providing a unified interface for diverse computational chemistry applications.</p>
<p class="mt-1 card-cta">Read on ChemRxiv →</p>
</a>
</div>
<div class="section-header mt-3">
<h2 id="news">News & Updates</h2>
<p>Release announcements and project updates. See all releases on <a href="https://github.com/ClickFF/MAPLE/releases" target="_blank" rel="noopener noreferrer">GitHub</a>.</p>
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<div class="card-grid">
<a class="card" id="v0-1-3" href="https://github.com/ClickFF/MAPLE/releases/tag/v.0.1.3" target="_blank" rel="noopener noreferrer">
<div class="card-tag">Release — April 1, 2026</div>
<h3>MAPLE v0.1.3</h3>
<p>Expanded MD workflows with NVT/NPT support, GROMACS-style MDP configuration, restart/trajectory improvements, task-aware UMA sizing, MACEPol integration, and IRC/debug cleanup.</p>
<p class="mt-1 card-cta">Release notes on GitHub →</p>
</a>
<a class="card" id="v0-1-1" href="https://github.com/ClickFF/MAPLE/releases/tag/v.0.1.1" target="_blank" rel="noopener noreferrer">
<div class="card-tag">Release — February 7, 2026</div>
<h3>MAPLE v0.1.1</h3>
<p>Added AutoNEB with adaptive image insertion, NVE molecular dynamics, SDCG optimizer with GDIIS acceleration, new IRC integrators (EulerPC, HPC, LQA), rigid scan mode, and input/parser improvements.</p>
<p class="mt-1 card-cta">Release notes on GitHub →</p>
</a>
<a class="card" id="v0-1-0" href="https://github.com/ClickFF/MAPLE/releases/tag/v.0.1.0" target="_blank" rel="noopener noreferrer">
<div class="card-tag">Release — December 31, 2025</div>
<h3>MAPLE v0.1.0</h3>
<p>First public release with frequency analysis, broad ML potential support (ANI, AIMNet2, MACE-OFF23, UMA), geometry optimization, transition state search, IRC, PES scan, solvation, constraints, GPU acceleration, and D4 dispersion.</p>
<p class="mt-1 card-cta">Release notes on GitHub →</p>
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