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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Fix input file download and `nbsphinx` rendering #158

Closed FanwangM closed 2 years ago

FanwangM commented 2 years ago

The original block downloads the input files with the same directory of the Jupyter files, but this is redundant if one clones the repo. Moreover, if one runs the Procrustes analysis blocks without running the download block, it will result to errors as the file path it points to is not right. Now everything is fixed and running in Binder does not require people to download the input files.