- kinaseBindingModesKlifs.csv contains a raw extraction from klifs (https://klifs.vu-compmedchem.nl/) and the RCSB PDB (https://www.rcsb.org/). It's a plain extraction from KLIFS without any modification.
- establishReferenceSet.py is the python script to be used to build the aforementioned csv file.
-
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work on kinase binding mode paper using knowledge rather than plain ML
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