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@popelier-group

Popelier Group

GitHub account of the Popelier group.

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  1. ichor ichor Public

    Computational Chemistry Data Management Library for Machine Learning Force Field Development

    Python 4 1

  2. FEREBUS-v7 FEREBUS-v7 Public

    Fortran 7

  3. REG REG Public

    Relative Energy Gradient method (Paul Popelier group: The University of Manchester)

    Python 4 1

  4. PyMol-QTAIM PyMol-QTAIM Public

    PyMol-QTAIM visualiser plugin

    Python 1

  5. ferebus-paper-data ferebus-paper-data Public

  6. PyMol-REG PyMol-REG Public

    Visualisation of REG results through PyMol GUI

    Python

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