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  1. RMG-Py RMG-Py Public

    Forked from ReactionMechanismGenerator/RMG-Py

    Python version of the amazing Reaction Mechanism Generator (RMG).

    Python

  2. dgl-lifesci dgl-lifesci Public

    Forked from awslabs/dgl-lifesci

    Python package for graph neural networks in chemistry and biology

    Python 1