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Popular GitHub Repositories for Interatomic Potentials

Discover the most popular open-source projects and tools related to Interatomic Potentials, and stay updated with the latest development trends and innovations.

Hippynn

atomistic-machine-learning

python library for atomistic machine learning

1个月前

Apax

computational-chemistry

A flexible and performant framework for training machine learning potentials.

1个月前

Psik Workshop AL GAP

active-learning

GAP-AL tutorial for the Psi-k ML-IP 2021 tutorial workshop.

3年前