| A Molecular Modeling Approach to Identify Effective Antiviral Phytochemicals against the Main Protease of SARS-CoV-2 R Islam, R Parves, AS Paul, N Uddin, MS Rahman, AA Mamun, ... Journal of Biomolecular Structure and Dynamics, 1-20, 2020 | 322 | 2020 |
| Virtual screening, molecular dynamics and structure–activity relationship studies to identify potent approved drugs for Covid-19 treatment MM Rahman, T Saha, KJ Islam, RH Suman, S Biswas, EU Rahat, ... Journal of Biomolecular Structure and Dynamics 39 (16), 6231-6241, 2021 | 102 | 2021 |
| Antiviral peptides as promising therapeutics against SARS-CoV-2 SM Chowdhury, SA Talukder, AM Khan, N Afrin, MA Ali, R Islam, R Parves, ... The Journal of Physical Chemistry B 124 (44), 9785-9792, 2020 | 82 | 2020 |
| Structure and dynamics of membrane protein in SARS-CoV-2 R Mahtarin, S Islam, MJ Islam, MO Ullah, MA Ali, MA Halim Journal of Biomolecular Structure and Dynamics 40 (10), 4725-4738, 2022 | 80 | 2022 |
| Immunoinformatics and molecular modeling approach to design universal multi-epitope vaccine for SARS-CoV-2 MT Khan, MJ Islam, A Parihar, R Islam, TJ Jerin, R Dhote, MA Ali, ... Informatics in medicine unlocked 24, 100578, 2021 | 54 | 2021 |
| Phytochemicals-based targeting RdRp and main protease of SARS-CoV-2 using docking and steered molecular dynamic simulation: A promising therapeutic approach for Tackling COVID-19 A Parihar, ZF Sonia, F Akter, MA Ali, FT Hakim, MS Hossain Computers in Biology and Medicine 145, 105468, 2022 | 46 | 2022 |
| 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 | 46 | 2021 |
| Computational screening of 645 antiviral peptides against the receptor-binding domain of the spike protein in SARS-CoV-2 MMH Sakib, AA Nishat, MT Islam, MAR Uddin, MS Iqbal, FFB Hossen, ... Computers in Biology and Medicine 136, 104759, 2021 | 44 | 2021 |
| Antiviral phytochemicals as potent inhibitors against NS3 protease of dengue virus MM Rahman, S Biswas, KJ Islam, AS Paul, SK Mahato, MA Ali, MA Halim Computers in Biology and Medicine 134, 104492, 2021 | 27 | 2021 |
| Structure elucidation of menthol-based deep eutectic solvent using experimental and computational techniques MA Ali, MS Rahman, R Roy, P Gambill, DE Raynie, MA Halim The Journal of Physical Chemistry A 125 (12), 2402-2412, 2021 | 25 | 2021 |
| Cysteine focused covalent inhibitors against the main protease of SARS-CoV-2 AS Paul, R Islam, MR Parves, AA Mamun, I Shahriar, MI Hossain, ... Journal of Biomolecular Structure and Dynamics 40 (4), 1639-1658, 2022 | 23 | 2022 |
| Clouding phenomena and thermodynamics of TX-100+ polyethylene glycol mixture: influence of several electrolytes MJ Hossain, MM Rahman, MR Amin, MA Ali, S Rana, D Kumar, ... Chemical Papers 75, 1363-1375, 2021 | 16 | 2021 |
| Repurposing fusion inhibitor peptide against SARS‐CoV‐2 FM Efaz, S Islam, SA Talukder, S Akter, MZ Tashrif, MA Ali, MA Sufian, ... Journal of Computational Chemistry, 2021 | 15 | 2021 |
| Plant-based bioactive molecules for targeting of endoribonuclease using steered molecular dynamic simulation approach: a highly conserved therapeutic target against variants of … A Parihar, SS Ahmed, P Sharma, NK Choudhary, F Akter, MA Ali, ... Molecular Simulation 49 (12), 1267-1279, 2023 | 13 | 2023 |
| A comprehensive computational and principal component analysis on various choline chloride-based deep eutectic solvents to reveal their structural and spectroscopic properties MI Rain, H Iqbal, M Saha, MA Ali, HK Chohan, MS Rahman, MA Halim The Journal of Chemical Physics 155 (4), 2021 | 13 | 2021 |
| 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 | 9 | 2022 |
| Assessment of mixed micellization behavior of amitriptyline hydrochloride and TX-165 surfactant mixture in various media (aqueous/NaCl/urea) MA Rub, N Azum, SYM Alfaifi, MMH Sakib, MA Ali, S Mahbub, MA Halim, ... Journal of Molecular Liquids 383, 122073, 2023 | 6 | 2023 |
| Identification of Plant-Based Drug-like Molecules as Potential Inhibitors against hACE2 and S-RBD of SARS-CoV-2 using Multi-step Molecular Docking and Dynamic Simulation Approach. A Parihar, ZF Sonia, N kumar Choudhary, P Sharma, I Mahdi, FTH Hakim, ... | 6 | 2022 |
| Impact of salts on the phase separation and thermodynamic properties of mixed nonionic surfactants in absence/attendance of polyvinyl alcohol MA Ali, MR Amin, S Mahbub, MD Hossen, MA Hoque, D Kumar Zeitschrift für Physikalische Chemie 235 (12), 1747-1765, 2021 | 6 | 2021 |
| Comprehensive characterization of the coding and non-coding single nucleotide polymorphisms in the tumor protein p63 (TP63) gene using in silico tools S Akter, S Hossain, MA Ali, MI Hosen, HU Shekhar Biomolecules 11 (11), 1733, 2021 | 5 | 2021 |
Mohammad A. HalimAssistant Professor of Chemistry and Biochemistry, Kennesaw State University在 kennesaw.edu 的电子邮件经过验证
