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@NWChemEx

NWChemEx Community

Dedicated to developing high-performance, modular, scientific software by leveraging NWChemEx's infrastructure.
README.md

About the NWChemEx Community

TODO: Fill out rest of profile/README.md in .github repo!!!

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  1. PluginPlay PluginPlay Public

    An inversion-of-control framework for developing modular scientific software.

    C++ 13 2

  2. NWChemEx NWChemEx Public

    A top-level, user-focused, conglomerate repo for the NWChemEx project.

    Python 18 4

Repositories

Showing 10 of 29 repositories
  • CMakeBuild Public
    NWChemEx/CMakeBuild’s past year of commit activity
    CMake 1 3 0 0 Updated Dec 20, 2025
  • Integrals Public
    NWChemEx/Integrals’s past year of commit activity
    C++ 1 Apache-2.0 0 1 1 Updated Dec 16, 2025
  • NWXCMake Public

    CMake modules and toolchains for NWChemEx

    NWChemEx/NWXCMake’s past year of commit activity
    CMake 1 1 0 1 Updated Dec 15, 2025
  • ParallelZone Public

    You're travelling through another dimension, a dimension not only of CPUs and threads but of GPUs; a journey into a wondrous land whose boundaries are bandwidth limited. That's the signpost up ahead - your next stop, the ParallelZone!

    NWChemEx/ParallelZone’s past year of commit activity
    C++ 1 Apache-2.0 1 10 2 Updated Dec 15, 2025
  • PluginPlay Public

    An inversion-of-control framework for developing modular scientific software.

    NWChemEx/PluginPlay’s past year of commit activity
    C++ 13 Apache-2.0 2 38 (9 issues need help) 1 Updated Dec 15, 2025
  • NWChemEx Public

    A top-level, user-focused, conglomerate repo for the NWChemEx project.

    NWChemEx/NWChemEx’s past year of commit activity
    Python 18 Apache-2.0 4 7 0 Updated Dec 11, 2025
  • SCF Public
    NWChemEx/SCF’s past year of commit activity
    C++ 2 Apache-2.0 2 5 2 Updated Dec 11, 2025
  • ChemCache Public

    Basis sets, physical constants, geometries, basically any data you can just look up.

    NWChemEx/ChemCache’s past year of commit activity
    C++ 1 Apache-2.0 0 2 (1 issue needs help) 0 Updated Dec 11, 2025
  • NUX Public

    NWChemEx User Experience (NUX): Tools, functions, etc. to facilitate user workflows

    NWChemEx/NUX’s past year of commit activity
    C++ 1 Apache-2.0 0 0 0 Updated Dec 11, 2025
  • FriendZone Public

    Provides SimDE compatible APIs to existing packages

    NWChemEx/FriendZone’s past year of commit activity
    Python 1 Apache-2.0 1 0 1 Updated Dec 11, 2025
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