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Structure of compound 7 bound to SARS-CoV-2 main protease

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Protein Data Bank Japan2024-07-03 更新2026-04-11 收录
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Structure of compound 7 bound to SARS-CoV-2 main protease Descriptor: 1,2-ETHANEDIOL, 1-[(2~{S})-2-(3-chlorophenyl)pyrrolidin-1-yl]-2-(5-methylpyridin-3-yl)ethanone, 3C-like proteinase, ... Authors: Mac Sweeney, A, Hazemann, J. Deposit date: 2023-11-01 Release date: 2024-02-07 Last modified: 2024-07-03 Method: X-RAY DIFFRACTION (1.31 Å) Cite: Identification of SARS-CoV-2 Mpro inhibitors through deep reinforcement learning for de novo drug design and computational chemistry approaches. Rsc Med Chem, 15, 2024

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2023-11-01
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