Neural Network Models for Prediction of Biological Activity using Molecular Dynamics Data: A Case of Photoswitchable Peptides

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Authors: Anton Cherednichenko, Sergii Afonin, Oleg Babii, Taras Voitsitskyi, Roman Stratiichuk, Ihor Koleiev, Volodymyr Vozniak, Nazar Shevchuk, Zakhar Ostrovsky, Semen Yesylevskyy, Alan Nafiiev, Serhii Starosyla, Anne S. Ulrich, Aigars Jirgensons, Igor V. Komarov

Journal title: Molecular Informatics

Journal number: 44

Journal publisher: Wiley - VCH Verlag GmbH & CO. KGaA

Published year: 2025

Published pages: e70001

DOI identifier: 10.1002/minf.70001

ISSN: 1868-1743