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Novel computational and drug design strategies for inhibition of monkeypox virus and Babesia microti: molecular docking, molecular dynamic simulation and drug design approach by natural compounds.
Akash S, Mir SA, Mahmood S, Hossain S, Islam MR, Mukerjee N, Nayak B, Nafidi HA, Bin Jardan YA, Mekonnen A, Bourhia M. Akash S, et al. Among authors: mukerjee n. Front Microbiol. 2023 Jul 19;14:1206816. doi: 10.3389/fmicb.2023.1206816. eCollection 2023. Front Microbiol. 2023. PMID: 37538847 Free PMC article.
A drug design strategy based on molecular docking and molecular dynamics simulations applied to development of inhibitor against triple-negative breast cancer by Scutellarein derivatives.
Akash S, Aovi FI, Azad MAK, Kumer A, Chakma U, Islam MR, Mukerjee N, Rahman MM, Bayıl I, Rashid S, Sharma R. Akash S, et al. Among authors: mukerjee n. PLoS One. 2023 Oct 12;18(10):e0283271. doi: 10.1371/journal.pone.0283271. eCollection 2023. PLoS One. 2023. PMID: 37824496 Free PMC article.
Mechanistic inhibition of Monkeypox and Marburg virus infection by O-rhamnosides and Kaempferol-o-rhamnosides derivatives: a new-fangled computational approach.
Al Mashud MA, Kumer A, Mukerjee N, Chandro A, Maitra S, Chakma U, Dey A, Akash S, Alexiou A, Khan AA, Alanazi AM, Ghosh A, Chen KT, Sharma R. Al Mashud MA, et al. Among authors: mukerjee n. Front Cell Infect Microbiol. 2023 May 24;13:1188763. doi: 10.3389/fcimb.2023.1188763. eCollection 2023. Front Cell Infect Microbiol. 2023. PMID: 37293201 Free PMC article.
Modified coptisine derivatives as an inhibitor against pathogenic Rhizomucor miehei, Mycolicibacterium smegmatis (Black Fungus), Monkeypox, and Marburg virus by molecular docking and molecular dynamics simulation-based drug design approach.
Akash S, Hossain A, Mukerjee N, Sarker MMR, Khan MF, Hossain MJ, Rashid MA, Kumer A, Ghosh A, León-Figueroa DA, Barboza JJ, Padhi BK, Sah R. Akash S, et al. Among authors: mukerjee n. Front Pharmacol. 2023 Apr 19;14:1140494. doi: 10.3389/fphar.2023.1140494. eCollection 2023. Front Pharmacol. 2023. PMID: 37153804 Free PMC article.
Discovery of Novel HSP27 Inhibitors as Prospective Anti-Cancer Agents Utilizing Computer-Assisted Therapeutic Discovery Approaches.
Umar HI, Ajayi AT, Mukerjee N, Aborode AT, Hasan MM, Maitra S, Bello RO, Alabere HO, Sanusi AA, Awolaja OO, Alshehri MM, Chukwuemeka PO, Aljarba NH, Alkahtani S, Malik S, Alexiou A, Ghosh A, Rahman MH. Umar HI, et al. Among authors: mukerjee n. Cells. 2022 Aug 4;11(15):2412. doi: 10.3390/cells11152412. Cells. 2022. PMID: 35954254 Free PMC article.
Interrelation between extracellular vesicles miRNAs with chronic lung diseases.
Dhar R, Mukherjee S, Mukerjee N, Mukherjee D, Devi A, Ashraf GM, Alserihi RF, Tayeb HH, Hashem AM, Alexiou A, Thorate N. Dhar R, et al. Among authors: mukerjee n. J Cell Physiol. 2022 Nov;237(11):4021-4036. doi: 10.1002/jcp.30867. Epub 2022 Sep 5. J Cell Physiol. 2022. PMID: 36063496 Review.
114 results