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@OpenBioSim

The OpenBioSim Community Interest Company

Popular repositories Loading

  1. biosimspace biosimspace Public

    An interoperable Python framework for biomolecular simulation.

    Python 146 19

  2. sire sire Public

    Sire Molecular Simulations Framework

    C++ 64 15

  3. biosimspace_tutorials biosimspace_tutorials Public

    A tutorials suite for BioSimSpace.

    Jupyter Notebook 34 8

  4. somd2 somd2 Public

    SOMD2: GPU accelerated free-energy perturbation engine

    Python 10 3

  5. loch loch Public

    GPU accelerated GCMC water sampling

    Python 10

  6. ghostly ghostly Public

    Ghost atom bonded term modifications for alchemical free energy simulations

    Python 6 1

Repositories

Showing 10 of 20 repositories
  • biosimspace Public

    An interoperable Python framework for biomolecular simulation.

    OpenBioSim/biosimspace’s past year of commit activity
    Python 146 GPL-3.0 19 12 2 Updated Feb 24, 2026
  • ligand_fep_workflows Public

    Snakemake workflows for ligand FEP

    OpenBioSim/ligand_fep_workflows’s past year of commit activity
    Python 0 GPL-3.0 0 0 0 Updated Feb 24, 2026
  • biosimspace_website Public

    Repository used to build and host the BioSimSpace website.

    OpenBioSim/biosimspace_website’s past year of commit activity
    Python 0 0 0 0 Updated Feb 24, 2026
  • ghostly Public

    Ghost atom bonded term modifications for alchemical free energy simulations

    OpenBioSim/ghostly’s past year of commit activity
    Python 6 GPL-3.0 1 1 1 Updated Feb 19, 2026
  • sire Public

    Sire Molecular Simulations Framework

    OpenBioSim/sire’s past year of commit activity
    C++ 64 GPL-3.0 15 11 0 Updated Feb 18, 2026
  • somd2 Public

    SOMD2: GPU accelerated free-energy perturbation engine

    OpenBioSim/somd2’s past year of commit activity
    Python 10 GPL-3.0 3 1 0 Updated Feb 17, 2026
  • loch Public

    GPU accelerated GCMC water sampling

    OpenBioSim/loch’s past year of commit activity
    Python 10 GPL-3.0 0 1 0 Updated Feb 17, 2026
  • sire_website Public

    Repository used to build and host the sire website

    OpenBioSim/sire_website’s past year of commit activity
    Python 0 1 0 0 Updated Feb 4, 2026
  • biosimspace_tutorials Public

    A tutorials suite for BioSimSpace.

    OpenBioSim/biosimspace_tutorials’s past year of commit activity
    Jupyter Notebook 34 GPL-3.0 8 10 1 Updated Oct 22, 2025
  • rbfe_workflow Public

    RBFE End-to-End workflow using BioSimSpace and sire.

    OpenBioSim/rbfe_workflow’s past year of commit activity
    Python 1 GPL-3.0 1 0 0 Updated Oct 10, 2025
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