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@OpenChemistry

Open Chemistry

Permissively licensed cross-platform tools that provide applications for computational chemistry, materials science, and related areas.

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  1. avogadrolibs avogadrolibs Public

    Avogadro libraries provide 3D rendering, visualization, analysis and data processing useful in computational chemistry, molecular modeling, bioinformatics, materials science, and related areas.

    C++ 480 178

  2. tomviz tomviz Public

    Cross platform, open source application for the processing, visualization, and analysis of 3D tomography data

    C++ 328 87

  3. avogadroapp avogadroapp Public

    Avogadro is an advanced molecular editor designed for cross-platform use in computational chemistry, molecular modeling, bioinformatics, materials science, and related areas.

    C++ 192 72

  4. chemicaljson chemicaljson Public

    Development of the Chemical JSON data representation

    Python 63 15

Repositories

Showing 10 of 57 repositories
  • avogadroapp Public

    Avogadro is an advanced molecular editor designed for cross-platform use in computational chemistry, molecular modeling, bioinformatics, materials science, and related areas.

    OpenChemistry/avogadroapp’s past year of commit activity
    C++ 192 BSD-3-Clause 72 10 (1 issue needs help) 7 Updated Dec 30, 2024
  • avogadrolibs Public

    Avogadro libraries provide 3D rendering, visualization, analysis and data processing useful in computational chemistry, molecular modeling, bioinformatics, materials science, and related areas.

    OpenChemistry/avogadrolibs’s past year of commit activity
    C++ 480 BSD-3-Clause 178 94 (14 issues need help) 17 Updated Dec 30, 2024
  • stempy Public

    Toolkit for 4D STEM processing on HPC using a Python interface and C++ engine. https://stempy.readthedocs.io/

    OpenChemistry/stempy’s past year of commit activity
    C++ 23 BSD-3-Clause 11 20 7 Updated Dec 20, 2024
  • openchemistry Public

    Supermodule containing submodules and external project to build all components

    OpenChemistry/openchemistry’s past year of commit activity
    CMake 82 BSD-3-Clause 61 4 2 Updated Dec 19, 2024
  • distiller Public
    OpenChemistry/distiller’s past year of commit activity
    Python 5 BSD-3-Clause 2 13 11 Updated Dec 19, 2024
  • molequeue Public

    Desktop integration of high performance computing resources

    OpenChemistry/molequeue’s past year of commit activity
    C++ 26 BSD-3-Clause 23 5 0 Updated Oct 25, 2024
  • avogenerators Public

    Python input file generators for Avogadro 2

    OpenChemistry/avogenerators’s past year of commit activity
    Python 11 18 1 (1 issue needs help) 0 Updated Jul 6, 2024
  • tomviz Public

    Cross platform, open source application for the processing, visualization, and analysis of 3D tomography data

    OpenChemistry/tomviz’s past year of commit activity
    C++ 328 BSD-3-Clause 87 127 10 Updated Jun 28, 2024
  • chemicaljson Public

    Development of the Chemical JSON data representation

    OpenChemistry/chemicaljson’s past year of commit activity
    Python 63 15 6 1 Updated Jun 10, 2024
  • crystals Public

    Crystallographic files of common materials, elements, oxides, for visualization in Avogadro

    OpenChemistry/crystals’s past year of commit activity
    16 3 0 0 Updated Apr 22, 2024
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