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Projects in Awesome Lists tagged with python-chemistry

A curated list of projects in awesome lists tagged with python-chemistry .

https://github.com/berquist/pymolresponse

Molecular frequency-dependent response properties for arbitrary operators

computational-chemistry hacktoberfest python python-chemistry quantum-chemistry

Last synced: 19 Jan 2026

https://github.com/berquist/pyints

Tools for evaluating molecular integrals in Python.

integrals python-chemistry quantum-chemistry

Last synced: 19 Jan 2026