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pypi.org "machine-learned-interatomic-potentials" keyword

View the packages on the pypi.org package registry that are tagged with the "machine-learned-interatomic-potentials" keyword.

autoplex 0.1.4
Automated machine-learned Potential Landscape explorer
10 versions - Latest release: 2 months ago - 123 downloads last month - 114 stars on GitHub - 1 maintainer
pet-mad 1.4.1
A universal interatomic potential for advanced materials modeling
11 versions - Latest release: 7 days ago - 1.16 thousand downloads last month - 67 stars on GitHub - 2 maintainers
Related Keywords
high-throughput 1 automated 1 mlpotential 1 atomistic-machine-learning 1 atomistic-modelling 1 atomistic-simulations 1 high-throughput-computing 1 ml-potentials 1 mlips 1 machine learning 1 molecular modeling 1 machine-learning 1 molecular-dynamics 1 universal-potential 1