Ecosyste.ms: Packages
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conda-forge.org : nequip
NequIP is a code for building E(3)-equivariant interatomic potentials
Registry
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Source
- JSON
purl: pkg:conda/nequip
Keywords: atomistic-simulations, computational-chemistry, deep-learning, drug-discovery, force-fields, interatomic-potentials, machine-learning, materials-science, molecular-dynamics, pytorch
License: MIT
Latest release: almost 2 years ago
First release: almost 2 years ago
Stars: 325 on GitHub
Forks: 72 on GitHub
See more repository details: repos.ecosyste.ms
Last synced: 3 days ago