Investigating the binding affinity, interaction, and structure-activity-relationship of 76 prescription antiviral drugs targeting RdRp and Mpro of SARS-CoV-2 S Ahmed, R Mahtarin, SS Ahmed, S Akter, MS Islam, AA Mamun, R Islam, ... Journal of Biomolecular Structure and Dynamics 39 (16), 6290-6305, 2021 | 51 | 2021 |
Virtual screening, molecular dynamics, density functional theory and quantitative structure activity relationship studies to design peroxisome proliferator-activated receptor-γ … S Ahmed, N Islam, M Shahinozzaman, SO Fakayode, N Afrin, MA Halim Journal of Biomolecular Structure and Dynamics 39 (2), 728-742, 2021 | 32 | 2021 |
Halogenated derivatives of methotrexate as human dihydrofolate reductase inhibitors in cancer chemotherapy N Uddin, S Ahmed, AM Khan, M Mazharol Hoque, MA Halim Journal of Biomolecular Structure and Dynamics 38 (3), 901-917, 2020 | 20 | 2020 |
A computational approach to explore and identify potential herbal inhibitors for the p21-activated kinase 1 (PAK1) M Shahinozzaman, T Ishii, S Ahmed, MA Halim, S Tawata Journal of Biomolecular Structure and Dynamics 38 (12), 3514-3526, 2020 | 15 | 2020 |
Remdesivir analogs against SARS-CoV-2 RNA-dependent RNA polymerase S Ahmed, R Mahtarin, MS Islam, S Das, A Al Mamun, SS Ahmed, MA Ali Journal of Biomolecular Structure and Dynamics 40 (21), 11111-11124, 2022 | 8 | 2022 |
Isolation and In Silico Prediction of Potential Drug-like Compounds with a New Dimeric Prenylated Quinolone Alkaloid from Zanthoxylum rhetsa (Roxb.) Root … FT Zohora, ATMZ Azam, S Ahmed, KM Rahman, MA Halim, MR Anwar, ... Molecules 27 (23), 8191, 2022 | 6 | 2022 |
Synthesis of bis [benzyl‐N′‐hydrazinecarbodithioato‐κ2 N′, S] nickel (II) complex as a novel lead molecule for cancer treatment R Zahan, S Ahmed, T Sharmin, MA Halim, MS Rahi, MC Sheikh, ... Applied Organometallic Chemistry, e6036, 2020 | 5 | 2020 |
Designing potent inhibitors against the multidrug resistance P-glycoprotein S Mahmud, MJ Islam, MR Parves, MA Khan, L Tabussum, S Ahmed, ... Journal of Biomolecular Structure and Dynamics 40 (19), 9403-9415, 2022 | 4 | 2022 |
Investigation of the impact of nonsynonymous mutations on thyroid peroxidase dimer MN Begum, R Mahtarin, S Ahmed, I Shahriar, SR Hossain, MW Mia, ... PloS One 18 (9), e0291386, 2023 | 3 | 2023 |
Molecular modelling approaches predicted 1, 2, 3-triazolyl ester of ketorolac (15K) to be a novel allosteric modulator of the oncogenic kinase PAK1 M Shahinozzaman, S Ahmed, R Emran, S Tawata Scientific Reports 11 (1), 17471, 2021 | 3 | 2021 |
Molecular investigation of TSHR gene in Bangladeshi congenital hypothyroid patients MN Begum, R Mahtarin, MT Islam, S Ahmed, TK Konika, K Mannoor, ... PloS one 18 (8), e0282553, 2023 | 2 | 2023 |