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  1. making-it-rain making-it-rain Public

    Cloud-based molecular simulations for everyone

    Rich Text Format 393 107

  2. Cloud-Bind Cloud-Bind Public

    Cloud-based Drug Binding Structure Prediction

    Jupyter Notebook 32 11

  3. ParametrizANI ParametrizANI Public

    Dihedral Parametrization in the Cloud with TorchANI

    Jupyter Notebook 10 1

  4. trmsfkit trmsfkit Public

    A package to perform time-dependent RMSF analysis on molecular dynamics data.

    Python 1