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GitHub / rdkit / rdkit

The official sources for the RDKit library

JSON API: https://repos.ecosyste.ms/api/v1/hosts/GitHub/repositories/rdkit%2Frdkit

Stars: 2,472
Forks: 845
Open Issues: 960

License: bsd-3-clause
Language: HTML
Repo Size: 195 MB
Dependencies: 12

Created: about 11 years ago
Updated: 1 day ago
Last pushed: 3 days ago
Last synced: 1 day ago

Commit Stats

Commits: 6844
Authors: 215
Mean commits per author: 31.83
Development Distribution Score: 0.302
More commit stats: https://commits.ecosyste.ms/hosts/GitHub/repositories/rdkit/rdkit

Topics: c-plus-plus, cheminformatics, python, rdkit

Files
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    Readme
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    Dependencies
    .github/workflows/templates_updater.yml actions
    Code/Demos/boost/EBV_err/setup.py pypi
    Code/Demos/boost/cross_mod_err/setup.py pypi
    Code/Demos/boost/cross_module/setup.py pypi
    Code/Demos/boost/numpy/setup.py pypi
    Code/Demos/boost/overloads/setup.py pypi
    Code/Demos/boost/python_objs/setup.py pypi
    Code/Demos/boost/smartPtrsAndIters/setup.py pypi
    Code/MinimalLib/docker/Dockerfile docker
    Code/JavaWrappers/csharp_wrapper/RDKit2DotNet.csproj nuget
    Code/JavaWrappers/csharp_wrapper/RDKitCSharpTest/RDKitCSharpTest.csproj nuget
    Contrib/FreeWilson/requirements.txt pypi
    Contrib/FreeWilson/setup.py pypi
    Code/JavaWrappers/csharp_wrapper/RdkitTests/RDKitCSharpTest.csproj nuget
    Code/JavaWrappers/csharp_wrapper/swig_csharp/RDKitDotNetCoreWrapper.csproj nuget