0539587 - ÚOCHB 2022 RIV CH eng J - Journal Article
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
R&D Projects: GA MŠMT(CZ) EF16_019/0000729
Grant - others:AV ČR(CZ) L200551951
Institutional support: RVO:61388963
Keywords : SARS-CoV-2 main protease * COVID-19 * TCM * natural products * molecular dynamics * ensemble sampling
OECD category: Biochemistry and molecular biology
Impact factor: 5.545, year: 2021
Method of publishing: Open access
https://doi.org/10.3389/fchem.2020.595273
Permanent 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
R&D Projects: GA MŠMT(CZ) EF16_019/0000729
Grant - others:AV ČR(CZ) L200551951
Institutional support: RVO:61388963
Keywords : SARS-CoV-2 main protease * COVID-19 * TCM * natural products * molecular dynamics * ensemble sampling
OECD category: Biochemistry and molecular biology
Impact factor: 5.545, year: 2021
Method of publishing: Open access
https://doi.org/10.3389/fchem.2020.595273
Permanent Link: http://hdl.handle.net/11104/0318116