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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: chakma u. 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.
Investigation of the New Inhibitors by Sulfadiazine and Modified Derivatives of α-D-glucopyranoside for White Spot Syndrome Virus Disease of Shrimp by In Silico: Quantum Calculations, Molecular Docking, ADMET and Molecular Dynamics Study.
Kumer A, Chakma U, Rana MM, Chandro A, Akash S, Elseehy MM, Albogami S, El-Shehawi AM. Kumer A, et al. Among authors: chakma u. Molecules. 2022 Jun 8;27(12):3694. doi: 10.3390/molecules27123694. Molecules. 2022. PMID: 35744817 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: chakma u. PLoS One. 2023 Oct 12;18(10):e0283271. doi: 10.1371/journal.pone.0283271. eCollection 2023. PLoS One. 2023. PMID: 37824496 Free PMC article.