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6 followers · 4 following
  • University of Edinburgh
  • Edinburgh

Achievements

Achievement: QuickdrawAchievement: Pull Sharkx2Achievement: YOLO

Achievements

Achievement: QuickdrawAchievement: Pull Sharkx2Achievement: YOLO

Highlights

  • Pro

Organizations

@Erastova-group

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  1. Erastova-group/ClayCode Erastova-group/ClayCode Public

    automate the setup of atomistic clay models for classical molecular dynamics simulations with GROMACS

    Python 7 2

  2. ClayFF_Fe ClayFF_Fe Public

    ClayFF with Fe parameters

  3. MDAnalysis/mdanalysis MDAnalysis/mdanalysis Public

    MDAnalysis is a Python library to analyze molecular dynamics simulations.

    Python 1.3k 652

  4. Edinburgh-Chemistry-Teaching/Data-driven-chemistry Edinburgh-Chemistry-Teaching/Data-driven-chemistry Public template

    Jupyter Notebook 22 2