MolecularAI / REINVENT4

AI molecular design tool for de novo design, scaffold hopping, R-group replacement, linker design and molecule optimization.

Date Created 2023-10-20 (about a year ago)

Commits 158 (last one 14 days ago)

Stargazers 387 (3 this week)

Watchers 21 (0 this week)

Forks 95

License apache-2.0

Ranking

RepositoryStats indexes 595,890 repositories, of these MolecularAI/REINVENT4 is ranked #110,802 (81st percentile) for total stargazers, and #105,895 for total watchers. Github reports the primary language for this repository as Python, for repositories using this language it is ranked #18,706/119,419.

MolecularAI/REINVENT4 is also tagged with popular topics, for these it's ranked: deep-learning (#2,437/8511), ai (#1,084/4074), reinforcement-learning (#350/1337), neural-networks (#236/728), ml (#184/614), generative-ai (#140/580), transfer-learning (#67/314), chemistry (#21/179), drug-discovery (#19/120)

Other Information

MolecularAI/REINVENT4 has Github issues enabled, there is 1 open issue and 106 closed issues.

There have been 6 releases, the latest one was published on 2024-11-22 (29 days ago) with the name Release 4.5.

All Topics

ai ml chemistry astrazeneca drug-design deep-learning denovo-design generative-ai drug-discovery cheminformatics neural-networks transfer-learning molecule-generation reinforcement-learning

Star History

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Watcher History

Github watchers over time, collection started in '23

Recent Commit History

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

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Issue History

Languages

The primary language is Python but there's also others...

updated: 2024-12-17 @ 11:19pm, id: 707552952 / R_kgDOKixmuA