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FanwangM avatar FanwangM commented on July 21, 2024

Thank you for your interest in our package.

We haven't released procrustes to PyPI yet, but you can install it with

# download package with git or manually download the ZIP  file
git clone [email protected]:theochem/procrustes.git
#  install package with pip
cd procrustes
pip install .

Please let me know if it does not work. @geloescht

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FanwangM avatar FanwangM commented on July 21, 2024

I am going to close this issue for now. But feel free to reopen if you still have problems with package installation and I would be very happy to help.

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geloescht avatar geloescht commented on July 21, 2024

I can confirm that this works. It does install a number of dependencies that seem unnecessary for a production environment (sphinx, pytest), but that might have something to do with installing from a local directory rather than PyPI.
I hope Procrustes will be released soon! The methods in more common libraries such as SciPy are seriously lacking. Keep up the good work!

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FanwangM avatar FanwangM commented on July 21, 2024

Thanks for the nice words!!

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FarnazH avatar FarnazH commented on July 21, 2024

Thanks for your interest @geloescht. Just to let you know, we have released a dev version of procrustes on conda and pypi (see the updated installation instructions). We will release a main release in the coming days.

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