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In silico and POM analysis for potential antimicrobial agents of thymidine analogs by using molecular docking, molecular dynamics and ADMET profiling.
Hosen MA, Qais FA, Chtita S, Rahman IA, Almehdi AM, Ali F, Almalki FA, Hadda TB, Laaroussi H, Kawsar SMA. Hosen MA, et al. Among authors: hadda tb. Nucleosides Nucleotides Nucleic Acids. 2023;42(11):877-918. doi: 10.1080/15257770.2023.2215839. Epub 2023 May 26. Nucleosides Nucleotides Nucleic Acids. 2023. PMID: 37235455
In vitro and in vivo evaluation of the antimicrobial, antioxidant, cytotoxic, hemolytic activities and in silico POM/DFT/DNA-binding and pharmacokinetic analyses of new sulfonamide bearing thiazolidin-4-ones.
Hassan SA, Aziz DM, Abdullah MN, Bhat AR, Dongre RS, Hadda TB, Almalki FA, Kawsar SMA, Rahiman AK, Ahmed S, Abdellattif MH, Berredjem M, Sheikh SA, Jamalis J. Hassan SA, et al. Among authors: hadda tb. J Biomol Struct Dyn. 2024 Apr;42(7):3747-3763. doi: 10.1080/07391102.2023.2226713. Epub 2023 Jul 4. J Biomol Struct Dyn. 2024. PMID: 37402503
Novel saccharin analogs as promising antibacterial and anticancer agents: synthesis, DFT, POM analysis, molecular docking, molecular dynamic simulations, and cell-based assay.
Abdellattif MH, Elkamhawy A, Hagar M, Hadda TB, Shehab WS, Mansy W, Belal A, Arief MMH, Hussien MA. Abdellattif MH, et al. Among authors: hadda tb. Front Pharmacol. 2022 Oct 4;13:958379. doi: 10.3389/fphar.2022.958379. eCollection 2022. Front Pharmacol. 2022. PMID: 36267293 Free PMC article.
Synthesis, antimicrobial, SAR, PASS, molecular docking, molecular dynamics and pharmacokinetics studies of 5'-O-uridine derivatives bearing acyl moieties: POM study and identification of the pharmacophore sites.
Munia NS, Hosen MA, Azzam KMA, Al-Ghorbani M, Baashen M, Hossain MK, Ali F, Mahmud S, Shimu MSS, Almalki FA, Hadda TB, Laaroussi H, Naimi S, Kawsar SMA. Munia NS, et al. Among authors: hadda tb. Nucleosides Nucleotides Nucleic Acids. 2022;41(10):1036-1083. doi: 10.1080/15257770.2022.2096898. Epub 2022 Jul 7. Nucleosides Nucleotides Nucleic Acids. 2022. PMID: 35797068
Crystallographic study, biological assessment and POM/Docking studies of pyrazoles-sulfonamide hybrids (PSH): Identification of a combined Antibacterial/Antiviral pharmacophore sites leading to in-silico screening the anti-Covid-19 activity.
Chalkha M, Nakkabi A, Hadda TB, Berredjem M, Moussaoui AE, Bakhouch M, Saadi M, Ammari LE, Almalki FA, Laaroussi H, Jevtovic V, Yazidi ME. Chalkha M, et al. Among authors: hadda tb. J Mol Struct. 2022 Nov 5;1267:133605. doi: 10.1016/j.molstruc.2022.133605. Epub 2022 Jun 28. J Mol Struct. 2022. PMID: 35782312 Free PMC article.
63 results