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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 118 18

  2. sire sire Public

    Sire Molecular Simulations Framework

    C++ 59 15

  3. biosimspace_tutorials biosimspace_tutorials Public

    A tutorials suite for BioSimSpace.

    Jupyter Notebook 25 5

  4. somd2 somd2 Public

    SOMD2: GPU accelerated free-energy perturbation engine

    Python 7 2

  5. openbiosetup openbiosetup Public archive

    Tools for biomolecular simulation preparation pipeline construction

    Python 2

  6. ghostly ghostly Public

    Ghost atom bonded modifications for alchemical free energy simulations

    Python 2

Repositories

Showing 10 of 17 repositories
  • nqcc-hackathon-2025 Public

    Code for OpenBioSim's use case for the NQCC 2025 Hackathon

    OpenBioSim/nqcc-hackathon-2025’s past year of commit activity
    Jupyter Notebook 0 GPL-3.0 0 0 0 Updated Jul 14, 2025
  • somd2 Public

    SOMD2: GPU accelerated free-energy perturbation engine

    OpenBioSim/somd2’s past year of commit activity
    Python 7 GPL-3.0 2 1 1 Updated Jul 10, 2025
  • biosimspace Public

    An interoperable Python framework for biomolecular simulation.

    OpenBioSim/biosimspace’s past year of commit activity
    Python 118 GPL-3.0 18 15 3 Updated Jul 10, 2025
  • sire Public

    Sire Molecular Simulations Framework

    OpenBioSim/sire’s past year of commit activity
    C++ 59 GPL-3.0 15 14 0 Updated Jul 8, 2025
  • ghostly Public

    Ghost atom bonded modifications for alchemical free energy simulations

    OpenBioSim/ghostly’s past year of commit activity
    Python 2 GPL-3.0 0 0 0 Updated Jul 2, 2025
  • 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 Jul 1, 2025
  • 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 May 20, 2025
  • biosimspace_tutorials Public

    A tutorials suite for BioSimSpace.

    OpenBioSim/biosimspace_tutorials’s past year of commit activity
    Jupyter Notebook 25 GPL-3.0 5 7 1 Updated May 1, 2025
  • containers Public

    Repository for the files used to create all of the OpenBioSim containers

    OpenBioSim/containers’s past year of commit activity
    Shell 0 0 0 0 Updated Nov 21, 2024
  • sire_bigtests Public

    The collection of larger integration test for sire. These are run before release, rather than run on every commit.

    OpenBioSim/sire_bigtests’s past year of commit activity
    Python 0 0 0 0 Updated Oct 22, 2024
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