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Pinned

  1. mol_opt mol_opt Public

    Python 155 30

  2. SynNet SynNet Public

    Python 75 20

  3. askcos_synthesizability askcos_synthesizability Public

    Jupyter Notebook 27 10

  4. mims-harvard/TDC mims-harvard/TDC Public

    Therapeutics Commons: Artificial Intelligence Foundation for Therapeutic Science

    Jupyter Notebook 933 167

  5. active_mpnn active_mpnn Public

    Active Learning with directed mpnn

    Python 5 1