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A universal QM/MM interface

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Name		Name	Last commit message	Last commit date
Latest commit History 267 Commits
.github		.github
devtools		devtools
docs		docs
qmhub		qmhub
.codecov.yml		.codecov.yml
.gitignore		.gitignore
.lgtm.yml		.lgtm.yml
CODE_OF_CONDUCT.md		CODE_OF_CONDUCT.md
LICENSE		LICENSE
MANIFEST.in		MANIFEST.in
README.md		README.md
pyproject.toml		pyproject.toml
setup.cfg		setup.cfg

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QMHub

A QM/MM interface.

Copyright

Copyright (c) 2019, Xiaoliang Pan

Acknowledgements

Project based on the Computational Molecular Science Python Cookiecutter version 1.1.

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A universal QM/MM interface

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Python 100.0%