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0539587 - ÚOCHB 2022 RIV CH eng J - Článek v odborném periodiku
Selvaraj, C. - Panwar, U. - Dinesh, Dhurvas Chandrasekaran - Bouřa, Evžen - Singh, P. - Dubey, V. K. - Singh, S. K.
Microsecond MD Simulation and Multiple-Conformation Virtual Screening to Identify Potential Anti-COVID-19 Inhibitors Against SARS-CoV-2 Main Protease.
Frontiers in Chemistry. Roč. 8, Jan 13 (2021), č. článku 595273. ISSN 2296-2646. E-ISSN 2296-2646
Grant CEP: GA MŠMT(CZ) EF16_019/0000729
Grant ostatní: AV ČR(CZ) L200551951
Institucionální podpora: RVO:61388963
Klíčová slova: SARS-CoV-2 main protease * COVID-19 * TCM * natural products * molecular dynamics * ensemble sampling
Obor OECD: Biochemistry and molecular biology
Impakt faktor: 5.545, rok: 2021
Způsob publikování: Open access
https://doi.org/10.3389/fchem.2020.595273
Trvalý link: http://hdl.handle.net/11104/0318116
Selvaraj, C. - Panwar, U. - Dinesh, Dhurvas Chandrasekaran - Bouřa, Evžen - Singh, P. - Dubey, V. K. - Singh, S. K.
Microsecond MD Simulation and Multiple-Conformation Virtual Screening to Identify Potential Anti-COVID-19 Inhibitors Against SARS-CoV-2 Main Protease.
Frontiers in Chemistry. Roč. 8, Jan 13 (2021), č. článku 595273. ISSN 2296-2646. E-ISSN 2296-2646
Grant CEP: GA MŠMT(CZ) EF16_019/0000729
Grant ostatní: AV ČR(CZ) L200551951
Institucionální podpora: RVO:61388963
Klíčová slova: SARS-CoV-2 main protease * COVID-19 * TCM * natural products * molecular dynamics * ensemble sampling
Obor OECD: Biochemistry and molecular biology
Impakt faktor: 5.545, rok: 2021
Způsob publikování: Open access
https://doi.org/10.3389/fchem.2020.595273
Trvalý link: http://hdl.handle.net/11104/0318116