cclib
cclib
Parsers and algorithms for computational chemistry logfiles
Languages
Top Repositories
Parsers and algorithms for computational chemistry logfiles
Computational chemistry logfiles used as regression tests by cclib
Parsers and algorithms for computational chemistry logfiles (Julia bindings to the cclib Python package).
Pages for cclib
Framework to build chemistry logfile data repository and access it through web
Sphinx theme for readthedocs.org
Repositories
9Parsers and algorithms for computational chemistry logfiles
Computational chemistry logfiles used as regression tests by cclib
Parsers and algorithms for computational chemistry logfiles (Julia bindings to the cclib Python package).
Pages for cclib
No description provided.
Framework to build chemistry logfile data repository and access it through web
Fork of https://github.com/rpmuller/pyquante2 that works for all Python versions
A Schema for Quantum Chemistry
Sphinx theme for readthedocs.org