What are the best Compchem repositories on GitHub?

The top-ranked Compchem open source repositories include patonlab/GoodVibes, OpenChemistry/avogadroapp, OpenChemistry/avogadrolibs, tracked and evaluated by community adoption, stars, and code commits.

How do I find trending Compchem open source tools?

Browse this curated Compchem directory to monitor real-time GitHub star velocity, latest code releases, and rising developer tools updated daily.

Are Compchem GitHub repositories free and open source?

Most Compchem projects listed here are distributed under open source licenses (such as MIT, Apache 2.0, or GPL). Always check individual project repositories for exact license terms.

Home / Topics / Compchem

Topic Catalog

Compchem GitHub Repositories (2026) · Open Source Tools

Discover the best Compchem open source repositories on GitHub. Explore trending tools, live star counts, source code, and developer projects updated daily.

SPONSORED BY

Kishan Kanani

Design & product building

Interviewly

Job search tools for developers

+ Advertise here

Your product in front of developers

+ Promote project

Get a video reel for your repo

3 matching projects · updated Nov 12, 2026 How we rank ↗

#1 TRENDING patonlab/GoodVibes Python 2016

Calculate quasi-harmonic free energies from Gaussian output files with temperature and other corrections

◇ compchem ◇ dispersion ◇ gaussian ◇ orca

55 ↑ +2 today

181

#2 TRENDING OpenChemistry/avogadroapp C++ 2012

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

◇ avogadro ◇ chemistry ◇ compchem ◇ cross-platform

91 ↑ +1 today

270

#3 TRENDING OpenChemistry/avogadrolibs C++ 2012

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

◇ avogadro ◇ chemistry ◇ compchem ◇ computational-chemistry

253 ↑ +1 today

696

From our network

Compchem GitHub Repositories (2026) · Open Source Tools

Built something? Put it in front of millions of developers.