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- W4312457300 abstract "Abstract30 imidazole-based drugs were designed, prepared and optimized using Gaussian 09, and were screened for drug-likeness with SWISS-ADME server. Molecular docking was performed using MOE 09, where the designed drugs were docked with the spike glycoprotein of the Delta (B.1.617.2) and Omicron (B.1.1.529) variant of SARS CoV-2. Nafamostat and Hydroxychloroquine were used as standards in comparing the docking results. Among the designed drugs, those drugs which used Benzil and Hyroxy/methoxy-benzaldehyde as the starting compound exhibited good binding scores, and can be potential inhibitors of the Delta and Omicron variant of SARS CoV-2.KeywordsSARS-CoV-2Imidazole-based drug designMolecular docking" @default.
- W4312457300 created "2023-01-04" @default.
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- W4312457300 date "2022-01-01" @default.
- W4312457300 modified "2023-09-27" @default.
- W4312457300 title "Design of Imidazole-Based Drugs as Potential Inhibitors of SARS-Cov-2 of the Delta and Omicron Variant" @default.
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- W4312457300 doi "https://doi.org/10.1007/978-3-030-99792-2_125" @default.
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