Descriptors calculation with PLEC
andregiuseppecavalli opened this issue · 0 comments
andregiuseppecavalli commented
Hi, I'm new in python so I'm not very good at it. I'm trying to calculate descriptors using PLEC similarly to what you have done in the PLECscore.py. To use the PLEC fingerprints do I have to convert them in descriptors using the universal_descriptor class? If so, how do i use in a ML model the obtained descriptor object?
Thank you
Andrea