Mahmud S - Search Results

1

Molecular docking and dynamics study to explore phytochemical ligand molecules against the main protease of SARS-CoV-2 from extensive phytochemical datasets.

Mahmud S, Mita MA, Biswas S, Paul GK, Promi MM, Afrose S, Hasan R, Shimu SS, Zaman S, Uddin S, Tallei TE, Emran TB, Saleh A. Mahmud S, et al. Expert Rev Clin Pharmacol. 2021 Oct;14(10):1305-1315. doi: 10.1080/17512433.2021.1959318. Epub 2021 Aug 5. Expert Rev Clin Pharmacol. 2021. PMID: 34301158

2

Computational discovery of plant-based inhibitors against human carbonic anhydrase IX and molecular dynamics simulation.

Mahmud S, Rahman E, Nain Z, Billah M, Karmakar S, Mohanto SC, Paul GK, Amin A, Acharjee UK, Saleh MA. Mahmud S, et al. J Biomol Struct Dyn. 2021 May;39(8):2754-2770. doi: 10.1080/07391102.2020.1753579. Epub 2020 Apr 29. J Biomol Struct Dyn. 2021. PMID: 32266872

3

Comparative molecular investigation of the potential inhibitors against SARS-CoV-2 main protease: a molecular docking study.

Khan MA, Mahmud S, Alam ASMRU, Rahman ME, Ahmed F, Rahmatullah M. Khan MA, et al. Among authors: mahmud s. J Biomol Struct Dyn. 2021 Oct;39(16):6317-6323. doi: 10.1080/07391102.2020.1796813. Epub 2020 Jul 22. J Biomol Struct Dyn. 2021. PMID: 32696718 Free PMC article.

4

Molecular docking and dynamics study of natural compound for potential inhibition of main protease of SARS-CoV-2.

Mahmud S, Uddin MAR, Zaman M, Sujon KM, Rahman ME, Shehab MN, Islam A, Alom MW, Amin A, Akash AS, Saleh MA. Mahmud S, et al. J Biomol Struct Dyn. 2021 Oct;39(16):6281-6289. doi: 10.1080/07391102.2020.1796808. Epub 2020 Jul 24. J Biomol Struct Dyn. 2021. PMID: 32705962 Free PMC article.

5

Screening of phytochemicals as potent inhibitor of 3-chymotrypsin and papain-like proteases of SARS-CoV2: an in silico approach to combat COVID-19.

Swargiary A, Mahmud S, Saleh MA. Swargiary A, et al. Among authors: mahmud s. J Biomol Struct Dyn. 2022 Mar;40(5):2067-2081. doi: 10.1080/07391102.2020.1835729. Epub 2020 Oct 22. J Biomol Struct Dyn. 2022. PMID: 33089730 Free PMC article.

6

Drug Repurposing Approach against Novel Coronavirus Disease (COVID-19) through Virtual Screening Targeting SARS-CoV-2 Main Protease.

Chowdhury KH, Chowdhury MR, Mahmud S, Tareq AM, Hanif NB, Banu N, Reza ASMA, Emran TB, Simal-Gandara J. Chowdhury KH, et al. Among authors: mahmud s. Biology (Basel). 2020 Dec 23;10(1):2. doi: 10.3390/biology10010002. Biology (Basel). 2020. PMID: 33374717 Free PMC article.

7

Virtual screening and molecular dynamics simulation study of plant-derived compounds to identify potential inhibitors of main protease from SARS-CoV-2.

Mahmud S, Uddin MAR, Paul GK, Shimu MSS, Islam S, Rahman E, Islam A, Islam MS, Promi MM, Emran TB, Saleh MA. Mahmud S, et al. Brief Bioinform. 2021 Mar 22;22(2):1402-1414. doi: 10.1093/bib/bbaa428. Brief Bioinform. 2021. PMID: 33517367 Free PMC article.

8

Chemical Profiles and Pharmacological Properties with in Silico Studies on Elatostema papillosum Wedd.

Uddin MZ, Paul A, Rakib A, Sami SA, Mahmud S, Rana MS, Hossain S, Tareq AM, Dutta M, Emran TB, Simal-Gandara J. Uddin MZ, et al. Among authors: mahmud s. Molecules. 2021 Feb 4;26(4):809. doi: 10.3390/molecules26040809. Molecules. 2021. PMID: 33557235 Free PMC article.

9

A molecular modelling approach for identifying antiviral selenium-containing heterocyclic compounds that inhibit the main protease of SARS-CoV-2: an in silico investigation.

Rakib A, Nain Z, Sami SA, Mahmud S, Islam A, Ahmed S, Siddiqui ABF, Babu SMOF, Hossain P, Shahriar A, Nainu F, Emran TB, Simal-Gandara J. Rakib A, et al. Among authors: mahmud s. Brief Bioinform. 2021 Mar 22;22(2):1476-1498. doi: 10.1093/bib/bbab045. Brief Bioinform. 2021. PMID: 33623995 Free PMC article.

10

Efficacy of Phytochemicals Derived from Avicennia officinalis for the Management of COVID-19: A Combined In Silico and Biochemical Study.

Mahmud S, Paul GK, Afroze M, Islam S, Gupt SBR, Razu MH, Biswas S, Zaman S, Uddin MS, Khan M, Cacciola NA, Emran TB, Saleh MA, Capasso R, Simal-Gandara J. Mahmud S, et al. Molecules. 2021 Apr 12;26(8):2210. doi: 10.3390/molecules26082210. Molecules. 2021. PMID: 33921289 Free PMC article.

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