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@ADicksonLab

ADicksonLab

Popular repositories

  1. wepy wepy Public

    Weighted Ensemble simulation framework in Python

    Python 48 20

  2. CSNAnalysis CSNAnalysis Public

    Tools for creating, analyzing and visualizing Conformation Space Networks

    Python 15 3

  3. OpenRXN OpenRXN Public

    A free, open-source tool for modeling chemical reaction networks in Python

    Python 12 2

  4. flexibletopology flexibletopology Public

    ML-based molecular representation models using PyTorch

    Python 10 3

  5. mastic mastic Public

    Multi-Atom Structure/Selection Toolkit with Interaction Capabilities

    Python 9 1

  6. ml4md-jb ml4md-jb Public

    Jupyter book and content for "Machine Learning for Molecular Dynamics" course

    Jupyter Notebook 9 3

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