Augmenting a training dataset of the generative diffusion model for molecular docking with artificial binding pockets

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Authors: Taras Voitsitskyi, Volodymyr Bdzhola, Roman Stratiichuk, Ihor Koleiev, Zakhar Ostrovsky, Volodymyr Vozniak, Ivan Khropachov, Pavlo Henitsoi, Leonid Popryho, Roman Zhytar, Semen Yesylevskyy, Alan Nafiiev, Serhii Starosyla

Journal title: RSC Advances

Journal number: 14

Journal publisher: RSC

Published year: 2024

DOI identifier: 10.1039/D3RA08147H

ISSN: 2046-2069