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  • MDAnalysis is a Python library to analyze molecular dynamics simulations.

    Python Other Updated Feb 19, 2025
  • Updated Dec 5, 2024
  • gromacs Public

    Forked from gromacs/gromacs

    Public/backup repository of the GROMACS molecular simulation toolkit. Please do not mine the metadata blindly; we use https://gitlab.com/gromacs/gromacs for code review and issue tracking.

    C++ GNU Lesser General Public License v2.1 Updated Aug 30, 2024
  • lammps Public

    Forked from lammps/lammps

    Public development project of the LAMMPS MD software package

    C++ GNU General Public License v2.0 Updated Aug 22, 2024
  • freud Public

    Forked from glotzerlab/freud

    Powerful, efficient particle trajectory analysis in scientific Python.

    C++ BSD 3-Clause "New" or "Revised" License Updated Aug 1, 2024
  • Python Updated Jul 31, 2022
  • A plug-in for HOOMD-Blue, a particle simulation toolkit, that implements soft continuous-polydisperse particles for molecular dynamics on the CPUs and GPUs.

    C++ BSD 3-Clause "New" or "Revised" License Updated Jul 15, 2022
  • Fractal analysis of high dimensional points using various methods

    Python Updated Jul 14, 2022
  • Molecular dynamics and Monte Carlo soft matter simulation on GPUs.

    C++ BSD 3-Clause "New" or "Revised" License Updated Jun 22, 2022
  • lab_site Public

    Forked from rar-ensemble/lab_site

    Jekyll source code to generate Rob Riggleman's research lab website

    HTML Updated Apr 19, 2021
  • Tool to facilitate the creation of compute jobs with different parameters

    Python MIT License Updated Mar 3, 2021
  • pylevy Public

    Forked from josemiotto/pylevy

    Levy distributions for Python

    Python GNU General Public License v3.0 Updated Jan 21, 2021
  • Wales-pele Public

    Forked from pele-python/pele

    Wales' Python energy landscape explorer

    Python Other Updated Apr 30, 2019
  • Examples Public

    Forked from smcantab/Examples

    Many examples of many features of many software packages

    C++ Updated Sep 19, 2014