lab-cosmo / librascal

A scalable and versatile library to generate representations for atomic-scale learning
https://lab-cosmo.github.io/librascal/
GNU Lesser General Public License v2.1
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librascal still refers to deprecated skcosmo instead of skmatter #424

Closed cbenmahm closed 1 year ago

cbenmahm commented 1 year ago

When importing FPS or CUR using from rascal.utils import CURFilter, FPSFilter, we get the warning : Warning: skcosmo module not found. CUR and FPS filters will be unavailable..

Then, by installing skcosmo using pip install skcosmo and trying to import the filters again, we get another warning :

DeprecationWarning: This package has been renamed to scikit-matter (skmatter https://github.com/lab-cosmo/scikit-matter). This package will no longer be maintained and updated. Please install the new package using `pip install skmatter`