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Top 1 proteochemometrics open source projects
paccmann kinase binding residues
Comparison of active site and full kinase sequences for drug-target affinity prediction and molecular generation. Full paper: https://pubs.acs.org/doi/10.1021/acs.jcim.1c00889
✭ 29
python
machine-learning
knn
protein-ligand-interactions
kinases
active-sites
proteochemometrics
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