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  • Carnegie Mellon University

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  1. llnl/systems2atoms llnl/systems2atoms Public

    Jupyter Notebook 9 2

  2. facebookresearch/fairchem facebookresearch/fairchem Public

    FAIR Chemistry's library of machine learning methods for chemistry

    Python 1.9k 417

  3. ulissigroup/charge-density-models ulissigroup/charge-density-models Public

    Python 15 4