A critical overview of computational approaches employed for COVID-19 drug discovery
doi: 10.1039/d0cs01065k , 10.17615/bwe6-fp72 , 10.3929/ethz-b-000496964 , 10.26181/614c057d6c8b2 , 10.26181/14944416.v2
pmid: 34212944
pmc: PMC8371861
handle: 20.500.11850/496964
doi: 10.1039/d0cs01065k , 10.17615/bwe6-fp72 , 10.3929/ethz-b-000496964 , 10.26181/614c057d6c8b2 , 10.26181/14944416.v2
pmid: 34212944
pmc: PMC8371861
handle: 20.500.11850/496964
A critical overview of computational approaches employed for COVID-19 drug discovery
We cover diverse methodologies, computational approaches, and case studies illustrating the ongoing efforts to develop viable drug candidates for treatment of COVID-19.
- UNIVERSIDADE DE SAO PAULO Brazil
- University College London United Kingdom
- North Carolina Agricultural and Technical State University United States
- Carnegie Mellon University United States
- University of New Mexico United States
Antiviral Agents, Drug Discovery, [CHIM.CHEM] Chemical Sciences/Cheminformatics, Humans, Computer Simulation, DOCKING, BIOLOGICAL EVALUATION, Pandemics, Uncategorized, MAIN PROTEASE, Clinical Trials as Topic, IDENTIFICATION, QSAR, POTENT, SARS-CoV-2, Drug Repositioning, COVID-19, COVID-19 Drug Treatment, Chemistry, Drug Design, LIGAND-BINDING, SARS-COV-2 SPIKE PROTEIN, 3CL PROTEASE, INHIBITORS, Medicinal and biomolecular chemistry not elsewhere classified
Antiviral Agents, Drug Discovery, [CHIM.CHEM] Chemical Sciences/Cheminformatics, Humans, Computer Simulation, DOCKING, BIOLOGICAL EVALUATION, Pandemics, Uncategorized, MAIN PROTEASE, Clinical Trials as Topic, IDENTIFICATION, QSAR, POTENT, SARS-CoV-2, Drug Repositioning, COVID-19, COVID-19 Drug Treatment, Chemistry, Drug Design, LIGAND-BINDING, SARS-COV-2 SPIKE PROTEIN, 3CL PROTEASE, INHIBITORS, Medicinal and biomolecular chemistry not elsewhere classified
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