Essential Oils as Antiviral Agents, Potential of Essential Oils to Treat SARS-CoV-2 Infection: An In-Silico InvestigationArticle Published on 2020-05-122022-10-29 Journal: International Journal of Molecular Sciences [Category] COVID-19, MERS, SARS, [키워드] acute respiratory syndrome Antiviral antiviral agent Antiviral agents binding domain carried component Corona virus coronavirus COVID-19 COVID-19 symptoms docking docking score enzyme Essential essential oil essential oils hACE2 investigation Ligand M pro molecular docking molecular docking analysis normalized Oil pathogenic viruses Potential Protein Protein target RNA-dependent RNA polymerase SARS-CoV-2 SARS-CoV-2 main protease SARS-CoV-2 RdRp shown Spike protein target targets the SARS-CoV-2 unlikely virus [DOI] 10.3390/ijms21103426 PMC 바로가기 [Article Type] Article
Repurposing of known anti-virals as potential inhibitors for SARS-CoV-2 main protease using molecular docking analysisResearch-Article Published on 2020-04-302022-10-28 Journal: Bioinformation [Category] COVID-19, [키워드] 6LU7 affected Analysis Anti-viral antiviral drug approach AutoDock binding binding affinity candidate ChEMBL collected complex Compound confirmed case coronavirus country COVID-19 COVID-19 disease COVID-19 pandemic crystallographic structure database deaths disease docking drug effective feature HCV Health hepatitis C virus HIV Human immunodeficiency virus infections inhibitor inhibitors M pro molecular docking analysis new SARS-CoV-2 outbreak Patient PDB protease Protease inhibitor protocol repurposing SARS-CoV-2 SARS-CoV-2 main protease treat Treatment Vaccine viral disease Virtual screening was performed was used [DOI] 10.6026/97320630016301 PMC 바로가기 [Article Type] Research-Article
Molecular docking analysis of Withaferin A from Withania somnifera with the Glucose regulated protein 78 (GRP78) receptor and the SARS-CoV-2 main proteaseResearch-Article Published on 2020-04-302022-10-28 Journal: Bioinformation [Category] COVID-19, [키워드] Analysis Artemisinin binding energy cellular receptor Compound COVID-19 COVID-19 pandemic Critical docking effective feature GRP78 Interaction interaction pattern molecular docking analysis MPro protease Protein receptor regulated SARS-CoV-2 main protease the SARS-CoV-2 Withaferin A [DOI] 10.6026/97320630016411 PMC 바로가기 [Article Type] Research-Article
Synthesis and Biological Evaluation of Novel (thio)semicarbazone-Based Benzimidazoles as Antiviral Agents against Human Respiratory VirusesArticle Published on 2020-03-252022-10-30 Journal: Molecules [Category] Coronavirus, [키워드] (thio)semicarbazone-based benzimidazoles acute respiratory illness agent anti-coronavirus activity anti-influenza activity anti-RSV activity antiviral activity antiviral agent Antiviral agents binding Biological caused Combination Compound compounds Contact coronavirus derivative effective explained Human human respiratory viruses hydrazone-based benzimidazoles improvement influenza A virus inhibit inhibitor medical need Modification molecular docking analysis molecular modelling studies novel pathology Protein reported respiratory respiratory syncytial virus responsible ribavirin RNA virus RSV SAR subsequent synthesis these compound Treatment variety viruses [DOI] 10.3390/molecules25071487 PMC 바로가기 [Article Type] Article