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  • University of Oxford

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  1. MemProtMD MemProtMD Public

    Forked from pstansfeld/MemProtMD

    Jupyter Notebook

  2. umbrella_sampling umbrella_sampling Public

    Forked from owenvickery/umbrella_sampling

    setting up and analysing PMFs

    Python

  3. multipoles multipoles Public

    Forked from maroba/multipoles

    A Python package for multipole expansions of electrostatic or gravitational potentials

    Python

  4. ensemblr ensemblr Public

    python notebook with workflow for sorting AF2 reduced-MSA ensembles to find intermediate states, paths between end-states, etc.

    Python 2 1