Pharmacology & ToxicologybioRxivPreprint
3DProtDTA: the deep learning model for drug-target affinity prediction based on the residue-level protein graphs
T. Voitsitskyi, R. Stratiichuk, I. Koleiev…·S. Starosyla
This paper introduces 3DProtDTA, a deep learning model for drug-target affinity prediction using residue-level protein graphs and AlphaFold structures, showing superior performance on benchmark datasets.
DOI 10.1101/2022.11.24.517815