LPDI-EPFL / masif

MaSIF- Molecular surface interaction fingerprints. Geometric deep learning to decipher patterns in molecular surfaces.
Apache License 2.0
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Steps 2 and 3 missing in data_preparation? #17

Closed mpdunne closed 3 years ago

mpdunne commented 3 years ago

Goes straight from 1 to 4.

pablogainza commented 3 years ago

Yes, sorry - it is a legacy issue. There used to be steps 2 and 3 that were invocation of Matlab libraries but when the code was converted 100% to Python, those steps were incorporated into step 4.

mpdunne commented 3 years ago

Oh okay, thanks!