mir-group / nequip

NequIP is a code for building E(3)-equivariant interatomic potentials

Date Created 2021-03-15 (3 years ago)
Commits 1,876 (last one 7 days ago)
Stargazers 636 (4 this week)
Watchers 22 (0 this week)
Forks 139
License mit
Ranking

RepositoryStats indexes 584,353 repositories, of these mir-group/nequip is ranked #75,419 (87th percentile) for total stargazers, and #100,509 for total watchers. Github reports the primary language for this repository as Python, for repositories using this language it is ranked #12,038/116,326.

mir-group/nequip is also tagged with popular topics, for these it's ranked: deep-learning (#1,756/8389),  machine-learning (#1,754/7926),  pytorch (#1,159/5948),  molecular-dynamics (#9/116),  drug-discovery (#13/116),  computational-chemistry (#7/104)

Other Information

mir-group/nequip has 3 open pull requests on Github, 144 pull requests have been merged over the lifetime of the repository.

Github issues are enabled, there are 24 open issues and 71 closed issues.

There have been 16 releases, the latest one was published on 2024-07-09 (4 months ago) with the name 0.6.1.

Homepage URL: https://www.nature.com/articles/s41467-022-29939-5

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Recent Commit History

604 commits on the default branch (main) since jan '22

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Languages

The only known language in this repository is Python

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mir-group/nequip

updated: 2024-11-20 @ 02:43pm, id: 348154786 / R_kgDOFMBrog