Repurposing of eluxadoline as a SARS-CoV-2 main protease inhibitor: E-Pharmacophore based virtual screening, molecular docking, MM-GBSA calculations, and molecular dynamics simulations studies.
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| Title: | Repurposing of eluxadoline as a SARS-CoV-2 main protease inhibitor: E-Pharmacophore based virtual screening, molecular docking, MM-GBSA calculations, and molecular dynamics simulations studies. |
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| Authors: | Mohamed, Magdi A.1 maelhussein@ju.edu.sa, Alanazi, Alaa F.2, Alanazi, Waad A.2, Elsaman, Tilal1, Mohamed, Malik S.3, Eltayib, Eyman M.3 |
| Source: | Journal of Applied Pharmaceutical Science. Jan2025, Vol. 15 Issue 1, p102-110. 9p. |
| Database: | Academic Search Ultimate |
| ISSN: | 22313354 |
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| DOI: | 10.7324/JAPS.2024.204792 |
