pypi.org "machine-learning-force-field" keyword
Top 9.7% on pypi.org
19 versions - Latest release: over 1 year ago - 1 dependent package - 1 dependent repositories - 413 downloads last month - 467 stars on GitHub - 2 maintainers
maml 2025.4.3
MAterials Machine Learning (maml) is a machine learning library for materials science.19 versions - Latest release: over 1 year ago - 1 dependent package - 1 dependent repositories - 413 downloads last month - 467 stars on GitHub - 2 maintainers
mattersim 1.2.5
MatterSim: A Deep Learning Atomistic Model Across Elements, Temperatures and Pressures.17 versions - Latest release: 5 months ago - 24.3 thousand downloads last month - 602 stars on GitHub - 1 maintainer
kups 1.0.8
A toolkit for building high-performance molecular simulations on JAX.12 versions - Latest release: 23 days ago - 807 downloads last month - 235 stars on GitHub - 1 maintainer
chipsff 2024.11.30
CHIPSFF: A force field analysis toolkit1 version - Latest release: almost 2 years ago - 17 downloads last month - 14 stars on GitHub - 1 maintainer
dpmdtools 1.1.2
DPTools: CLI toolkit and python library for working with deepmd-kit.13 versions - Latest release: almost 4 years ago - 58 downloads last month - 11 stars on GitHub - 1 maintainer
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mlff
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materials-science
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machine-learning
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materials
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