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@molmod

Center for Molecular Modeling (CMM), Ghent University

Technologiepark 46, 9052 Zwijnaarde, Belgium

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  1. openmm-tutorial-msbs openmm-tutorial-msbs Public

    OpenMM tutorial for the MSBS course

    Jupyter Notebook 163 47

  2. psiflow psiflow Public

    scalable molecular simulation

    Python 136 13

  3. molmod molmod Public

    MolMod is a collection of molecular modelling tools for python.

    Python 59 21

  4. QuickFF QuickFF Public

    A Python code to quickly derive ab initio parameterized force fields.

    Python 41 15

  5. yaff yaff Public

    Yaff is yet another force-field code

    Python 35 18

  6. tamkin tamkin Public

    TAMkin is a post-processing toolkit for thermochemistry and kinetics analysis.

    Python 22 15

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