Luthaf / rascaline

Computing representations for atomistic machine learning
https://luthaf.fr/rascaline/
BSD 3-Clause "New" or "Revised" License
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Remove `generate_splines` from the docs #291

Open frostedoyster opened 5 months ago

frostedoyster commented 5 months ago

There is an old function, i.e. rascaline.generate_splines, which is still mentioned in the documentation. If I understand correctly, it was replaced by rascaline.utils.RadialIntegralFromFunction

PicoCentauri commented 5 months ago

rascaline.generate_splines is still in place, used by us (even though only internally) and has a public API. But you are right for the actual user we recommend rascaline.utils.RadialIntegralFromFunction. We make it private if you think this is confusing.