Ali I - Search Results

1

Comprehensive in silico analyses of flavonoids elucidating the drug properties against kidney disease by targeting AIM2.

Kandeel M, Iqbal MN, Ali I, Malik S, Malik A, Sehgal SA. Kandeel M, et al. Among authors: ali i. PLoS One. 2023 May 18;18(5):e0285965. doi: 10.1371/journal.pone.0285965. eCollection 2023. PLoS One. 2023. PMID: 37200367 Free PMC article.

2

Identification of Lead Compounds against Scm (fms10) in Enterococcus faecium Using Computer Aided Drug Designing.

Rasheed MA, Iqbal MN, Saddick S, Ali I, Khan FS, Kanwal S, Ahmed D, Ibrahim M, Afzal U, Awais M. Rasheed MA, et al. Among authors: ali i. Life (Basel). 2021 Jan 21;11(2):77. doi: 10.3390/life11020077. Life (Basel). 2021. PMID: 33494233 Free PMC article.

3

Identification of lead compound screened from the natural products atlas to treat renal inflammasomes using molecular docking and dynamics simulation.

Ullah S, Rahman W, Ullah F, Ullah A, Jehan R, Iqbal MN, Ali I, Tianshun G. Ullah S, et al. Among authors: ali i. J Biomol Struct Dyn. 2024 Jun;42(9):4851-4861. doi: 10.1080/07391102.2023.2254397. Epub 2023 Sep 13. J Biomol Struct Dyn. 2024. PMID: 37705295 Free article.

4

Computational exploration of novel ROCK2 inhibitors for cardiovascular disease management; insights from high-throughput virtual screening, molecular docking, DFT and MD simulation.

Ali I, Iqbal MN, Ibrahim M, Haq IU, Alonazi WB, Siddiqi AR. Ali I, et al. PLoS One. 2023 Nov 16;18(11):e0294511. doi: 10.1371/journal.pone.0294511. eCollection 2023. PLoS One. 2023. PMID: 37972144 Free PMC article.

5

Computational exploration and molecular dynamic simulation for the discovery of antiviral agents targeting Newcastle disease virus.

Ali I, Haq IU, Akbar NI, Iqbal MN, Rahim K, Khan AA, Alanazi AM, Rasheed MA. Ali I, et al. Microb Pathog. 2024 Nov;196:106884. doi: 10.1016/j.micpath.2024.106884. Epub 2024 Aug 26. Microb Pathog. 2024. PMID: 39197691

6

In-silico identification and exploration of small molecule coumarin-1,2,3-triazole hybrids as potential EGFR inhibitors for targeting lung cancer.

Kumar S, Ali I, Abbas F, Shafiq F, Yadav AK, Ghate MD, Kumar D. Kumar S, et al. Among authors: ali i. Mol Divers. 2024 Dec;28(6):4301-4324. doi: 10.1007/s11030-024-10817-9. Epub 2024 Mar 12. Mol Divers. 2024. PMID: 38470555

7

Identification of Natural Lead Compounds against Hemagglutinin-Esterase Surface Glycoprotein in Human Coronaviruses Investigated via MD Simulation, Principal Component Analysis, Cross-Correlation, H-Bond Plot and MMGBSA.

Ali I, Rasheed MA, Cavalu S, Rahim K, Ijaz S, Yahya G, Goh LPW, Popoviciu MS. Ali I, et al. Biomedicines. 2023 Mar 6;11(3):793. doi: 10.3390/biomedicines11030793. Biomedicines. 2023. PMID: 36979773 Free PMC article.

8

Identification and exploration of quinazoline-1,2,3-triazole inhibitors targeting EGFR in lung cancer.

Kumar S, Sengupta S, Ali I, Gupta MK, Lalhlenmawia H, Azizov S, Kumar D. Kumar S, et al. Among authors: ali i. J Biomol Struct Dyn. 2023;41(21):11353-11372. doi: 10.1080/07391102.2023.2204360. Epub 2023 Apr 28. J Biomol Struct Dyn. 2023. PMID: 37114510

9

In-silico design, pharmacophore-based screening, and molecular docking studies reveal that benzimidazole-1,2,3-triazole hybrids as novel EGFR inhibitors targeting lung cancer.

Kumar S, Ali I, Abbas F, Rana A, Pandey S, Garg M, Kumar D. Kumar S, et al. Among authors: ali i. J Biomol Struct Dyn. 2024 Nov;42(18):9416-9438. doi: 10.1080/07391102.2023.2252496. Epub 2023 Aug 30. J Biomol Struct Dyn. 2024. PMID: 37646177

10

In-silico identification of small molecule benzofuran-1,2,3-triazole hybrids as potential inhibitors targeting EGFR in lung cancer via ligand-based pharmacophore modeling and molecular docking studies.

Kumar S, Ali I, Abbas F, Khan N, Gupta MK, Garg M, Kumar S, Kumar D. Kumar S, et al. Among authors: ali i. In Silico Pharmacol. 2023 Aug 9;11(1):20. doi: 10.1007/s40203-023-00157-1. eCollection 2023. In Silico Pharmacol. 2023. PMID: 37575679 Free PMC article.

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