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@CNNs4QSPR CNNs4QSPR

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    • cnns4qspr

      Public
      A package for creating rich, equivariant, structural and chemical features from protein structure data.
      Python
      •
      MIT License
      •4•5•2•0•Updated Jan 26, 2021Jan 26, 2021

    • se3cnn

      Public
      Euclidean Neural Networks
      Python
      •
      MIT License
      •49•1•0•0•Updated Mar 23, 2020Mar 23, 2020

    • Protein-Ligand-Data-Wrangling

      Public
      A repository for collecting, storing, organizing, and accessing protein structure and protein-ligand binding data.
      Jupyter Notebook
      •
      MIT License
      •0•0•0•0•Updated Feb 13, 2020Feb 13, 2020