theochem / procrustes

Python library for finding the optimal transformation(s) that makes two matrices as close as possible to each other.
https://procrustes.qcdevs.org/
GNU General Public License v3.0
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Update tox.ini and .gitignore: docs --> doc #112

Closed FanwangM closed 3 years ago

FanwangM commented 3 years ago

This PR simply fixes the CI failure.