gaussianrunner

A Python script to run Gaussian automatically and in batches.

LGPL-3.0 License

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189
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gaussianrunner - v1.0.34 Latest Release

Published by njzjz about 1 year ago

What's Changed

New Contributors

Full Changelog: https://github.com/njzjz/gaussianrunner/compare/v1.0.33...v1.0.34

gaussianrunner - v1.0.33

Published by njzjz about 1 year ago

What's Changed

Full Changelog: https://github.com/njzjz/gaussianrunner/compare/v1.0.22...v1.0.33

gaussianrunner - v1.0.22

Published by njzjz over 3 years ago

fix: add openbabel-wheel to install_require (#68)

gaussianrunner -

Published by njzjz over 5 years ago

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