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Integrating virtual screening, pharmacoinformatics profiling, and molecular dynamics: identification of promising inhibitors targeting 3CLpro of SARS-CoV-2.
Mohammad A, Zheoat A, Oraibi A, Manaithiya A, S Almaary K, Allah Nafidi H, Bourhia M, Kilani-Jaziri S, A Bin Jardan Y. Mohammad A, et al. Among authors: manaithiya a. Front Mol Biosci. 2024 Mar 7;10:1306179. doi: 10.3389/fmolb.2023.1306179. eCollection 2023. Front Mol Biosci. 2024. PMID: 38516396 Free PMC article.
Corrigendum: Navigating bioactivity space in anti-tubercular drug discovery through the deployment of advanced machine learning models and cheminformatics tools: a molecular modeling based retrospective study.
Bhowmik R, Kant R, Manaithiya A, Saluja D, Vyas B, Nath R, Qureshi KA, Parkkila S, Aspatwar A. Bhowmik R, et al. Among authors: manaithiya a. Front Pharmacol. 2024 Jan 9;14:1340724. doi: 10.3389/fphar.2023.1340724. eCollection 2023. Front Pharmacol. 2024. PMID: 38264524 Free PMC article.
Navigating bioactivity space in anti-tubercular drug discovery through the deployment of advanced machine learning models and cheminformatics tools: a molecular modeling based retrospective study.
Bhowmik R, Kant R, Manaithiya A, Saluja D, Vyas B, Nath R, Qureshi KA, Parkkila S, Aspatwar A. Bhowmik R, et al. Among authors: manaithiya a. Front Pharmacol. 2023 Aug 29;14:1265573. doi: 10.3389/fphar.2023.1265573. eCollection 2023. Front Pharmacol. 2023. PMID: 37705534 Free PMC article. Review.
16 results