Luthaf / rascaline

Computing representations for atomistic machine learning
https://luthaf.fr/rascaline/
BSD 3-Clause "New" or "Revised" License
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Add examples/tutorials doing sample and feature selection #86

Open Luthaf opened 2 years ago

Luthaf commented 2 years ago

All of the code infrastructure is there, but the user-side documentation is missing.

If anyone want to give this a go, let me know!

Luthaf commented 1 year ago

This is solved for Python, but we still need an example for the Rust, C and C++ API