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  1. cgnn cgnn Public

    Crystal Graph Neural Networks

    Python 104 24

  2. MaterialsAreSimilarToDocuments MaterialsAreSimilarToDocuments Public

    Kaggle Competition Nomad2018 Discussions and Kernels

  3. PotFit PotFit Public

    A PyTorch Example of Potential Fitting

    Python 6 1

  4. pytorch_warmup pytorch_warmup Public

    Learning Rate Warmup in PyTorch

    Python 393 25

  5. oqmd-v1.2-dataset-for-cgnn oqmd-v1.2-dataset-for-cgnn Public

    Jupyter Notebook 3 1