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  1. kudi kudi Public

    Kudi: A free open-source python library for the analysis of properties along reaction paths

    Jupyter Notebook 2

  2. beep beep Public

    Forked from QCMM/beep

    A binding energy evaluation platform (BEEP) and database for molecules on interstellar ice-grain mantels

    Python

  3. MolSSI/QCFractal MolSSI/QCFractal Public

    A distributed compute and database platform for quantum chemistry.

    Python 163 55