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Open Chemistry @OpenChemistry

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

Science & Medicine
OpenChemistry
C++CMAKEPYTHON0 program years

Open Chemistry

@OpenChemistry · openchemistry.org

About the organization

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

Primary technologies & languages

C++CMakePython

Technical topics & focus areas

C++CMakePython

Participation years

202320242025
Work the Open Chemistry repositoriesFollow the repos you care about and track the issues you take, stage by stage, on your own board.Open board

Repositories on GitHublive from github.com/OpenChemistry, ranked by starsAll 63 repos

avogadrolibsC++693249

Avogadro libraries provide 3D rendering, visualization, analysis and data processing useful in computational chemistry, molecular modeling, bioinforma

91 open issues · good place to start if you want to contribute
tomvizC++36795

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

133 open issues · good place to start if you want to contribute
avogadroappC++27194

Avogadro is an advanced molecular editor designed for cross-platform use in computational chemistry, molecular modeling, bioinformatics, materials sci

9 open issues · good place to start if you want to contribute
openchemistryCMake9160

Supermodule containing submodules and external project to build all components

1 open issues · good place to start if you want to contribute
chemicaljsonPython7121

Development of the Chemical JSON data representation

9 open issues · good place to start if you want to contribute
molequeueC++3326

Desktop integration of high performance computing resources

7 open issues · good place to start if you want to contribute
stempyC++2612

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

20 open issues · good place to start if you want to contribute
crystalsOther205

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

moleculesOther177

Common molecule fragments for visualization in Avogadro

1 open issues · good place to start if you want to contribute
mongochemserverPython179

Server code for MongoChem chemical data

2 open issues · good place to start if you want to contribute