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10874. Ensemble Docking Coupled to Linear Interaction Energy Calculations for Identification of Coronavirus Main Protease (3CLpro) Non-Covalent Small-Molecule InhibitorsMarko Jukič, Dušanka Janežič, Urban Bren, 2020 Ključne besede: COVID-19, SARS-CoV-2, Mpro, 3CLpro, 3C-like protease, virtual screening, inhibitors, in silico drug design, free-energy calculations Objavljeno v DKUM: 10.12.2020; Ogledov: 1475; Prenosov: 197
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