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 152 (last one a day ago)

Stargazers 364 (7 this week)

Watchers 22 (0 this week)

Forks 89

License apache-2.0

Ranking

RepositoryStats indexes 584,353 repositories, of these MolecularAI/REINVENT4 is ranked #114,979 (80th 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 #19,391/116,326.

MolecularAI/REINVENT4 is also tagged with popular topics, for these it's ranked: deep-learning (#2,515/8389), ai (#1,067/3879), reinforcement-learning (#357/1309), neural-networks (#240/718), ml (#185/602), generative-ai (#135/546), transfer-learning (#71/310), chemistry (#24/174), drug-discovery (#20/116)

Other Information

MolecularAI/REINVENT4 has Github issues enabled, there are 2 open issues and 101 closed issues.

There have been 5 releases, the latest one was published on 2024-07-11 (4 months ago) with the name Release 4.4.

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

152 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: 2024-11-20 @ 05:23pm, id: 707552952 / R_kgDOKixmuA