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Pinned

  1. Open Drug Discovery Toolkit

    Python 94 45

  2. The official sources for the RDKit library

    C++ 686 341

  3. Open Babel is a chemical toolbox designed to speak the many languages of chemical data.

    C++ 309 231

  4. Compiled Decision Trees for scikit-learn

    Python 210 28

  5. RF-Score-VS - Random forest based protein-ligand scoring function for Virtual Screening

    Jupyter Notebook 13 1

  6. RF-Score-VS binary

    Python 9 3

150 contributions in 2018

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Contribution activity

December 2018

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