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3DProtDTA: a deep learning model for drug-target affinity prediction based on residue-level protein graphs.
RSC Adv. 2023 Mar 31;13(15):10261-10272. doi: 10.1039/d3ra00281k. eCollection 2023 Mar 27.
RSC Adv. 2023.
PMID: 37006369
Free PMC article.
Augmenting a training dataset of the generative diffusion model for molecular docking with artificial binding pockets.
Voitsitskyi T, Bdzhola V, Stratiichuk R, Koleiev I, Ostrovsky Z, Vozniak V, Khropachov I, Henitsoi P, Popryho L, Zhytar R, Yesylevskyy S, Nafiiev A, Starosyla S.
Voitsitskyi T, et al. Among authors: popryho l.
RSC Adv. 2024 Jan 3;14(2):1341-1353. doi: 10.1039/d3ra08147h. eCollection 2024 Jan 2.
RSC Adv. 2024.
PMID: 38174256
Free PMC article.
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