Chemical descriptors, PASS, molecular docking, molecular dynamics and ADMET predictions of glucopyranoside derivatives as inhibitors to bacteria and fungi growth SMA Kawsar, A Kumer, NS Munia, MA Hosen, U Chakma, S Akash Organic Communications 15 (2), 203, 2022 | 45 | 2022 |
The computational screening of inhibitor for black fungus and white fungus by D-glucofuranose derivatives using in silico and SAR study AK ,Unesco Chakma, Mohammed M. Matin, Shopnil Akash, Akhel Chandro, Debashis ... Organic Communications, 2021 | 37 | 2021 |
Modified D-glucofuranoses as new black fungus protease inhibitors: Computational screening, docking, dynamics, and QSAR study MA Rahman, MM Matin, A Kumer, U Chakma, MR Rahman Physical Chemistry Research 10 (2), 195-209, 2022 | 30 | 2022 |
Analysis of crystallographic structures and properties of silver nanoparticles synthesized using PKL extract and nanoscale characterization techniques MH Ali, MAK Azad, KA Khan, MO Rahman, U Chakma, A Kumer ACS omega 8 (31), 28133-28142, 2023 | 26 | 2023 |
Modified D-glucofuranose computationally screening for inhibitor of breast cancer and triple breast cancer: Chemical descriptor, molecular docking, molecular dynamics and QSAR A Kumer, U Chakma, A Chandro, D Howlader, S Akash, ME Kobir, ... Journal of the Chilean Chemical Society 67 (3), 5623-5635, 2022 | 25 | 2022 |
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 … A Kumer, U Chakma, MM Rana, A Chandro, S Akash, MM Elseehy, ... Molecules 27 (12), 3694, 2022 | 24 | 2022 |
Developing the amazing photocatalyst of ZnAg2GeSe4, ZnAg2Ge0. 93Fe0. 07Se4 and ZnAg2Ge0. 86Fe0. 14Se4 through the computational explorations by four DFT functionals A Kumer, U Chakma Heliyon 7 (7), 2021 | 22 | 2021 |
Studies on performance parameters of a practical transformer for various utilizations MH Ali, U Chakma, D Howlader, MT Islam, KA Khan MICROSYSTEM TECHNOLOGIES-MICRO-AND NANOSYSTEMS-INFORMATION STORAGE AND …, 2020 | 22 | 2020 |
Theoretical investigation of doping effect of Fe for SnWO4 in electronic structure and optical properties: DFT based first principle study M Hasan, A Kumer, U Chakma Adv. J. Chem. A 3, 639-644, 2020 | 22 | 2020 |
Molecular dynamics simulation, QSAR, DFT, molecular docking, ADMET, and synthesis of ethyl 3-((5-Bromopyridin-2-yl) Imino) butanoate analogues as potential inhibitors of SARS-CoV-2 FMM Ahamed, S Chinnam, M Challa, G Kariyanna, A Kumer, S Jadoun, ... Polycyclic Aromatic Compounds 44 (1), 294-312, 2024 | 20 | 2024 |
The computational screening of structural, electronic, and optical properties for SiC, Si0. 94Sn0. 06C, and Si0. 88Sn0. 12C lead-free photovoltaic inverters using DFT … M Ali, MJ Islam, M Rafid, RR Jeetu, R Roy, U Chakma, A Kumer Eurasian Chemical Communications 3 (5), 327-38, 2021 | 19 | 2021 |
Structural geometry, electronic structure, thermo-electronic and optical properties of GaCuO2 and GaCu0.94Fe0.06O2: a first principle approach of three DFT … D Howlader, MS Hossain, U Chakma, A Kumer, MJ Islam, MT Islam, ... Molecular Simulation 47 (17), 1411-1422, 2021 | 18 | 2021 |
A theoretical investigation for electronics structure of Mg (BiO2) 2 semiconductor using first principle approach KB Chakma, A Kumer, U Chakma, D Howlader, MT Islam International Journal of New Chemistry 7 (3), 247-255, 2020 | 17 | 2020 |
The exploration of structural, electronic and optical properties for MoS2 and Mo0. 95W0. 05S2 photocatalyst effort on wastewater treatment using DFT functional of first … MAM Sikder, U Chakma, A Kumer, MJ Islam, A Habib, MM Alam Applied Journal of Environmental Engineering Science 7 (1), 7-1 (2021) 103-113, 2021 | 16 | 2021 |
Electronics structure and optical properties of SrPbO3 and SrPb0. 94Fe0. 06O3: A first principle approach U Chakma, A Kumer, KB Chakma, M Islam, D Howlader, RMK Mohamed Eurasian Chemical Communications 2 (5), 573-580, 2020 | 16 | 2020 |
Electronics structure and optical properties of Ag2BiO3,(Ag2) 0.88 Fe0. 12BiO3: a first principle approach U Chakma, A Kumer, KB Chakma, MT Islam, D Howlader Advanced Journal of Chemistry-Section A 3 (4), 542-550, 2020 | 16 | 2020 |
Studies on Performance Para meters of a Practical Transformer for Various Utilizations MH Ali, U Chakma, D Howlader, MTIKA Khan 8 th international conference on CCSN2019 1, 2019 | 16 | 2019 |
Investigation of Structural, Electronic and Optical Properties of Na2InAgCl6, K2InAgCl6, and Rb2InAgCl6 Lead-Free Halide Double Perovskites Regarding with Cs2InAgCl … MH Ali, MJ Islam, A Kumer, MS Hossain, U Chakma, D Howlader, ... Materials Research 24, e20210086, 2021 | 15 | 2021 |
Computational investigation of Betalain derivatives as natural inhibitor against food borne bacteria F Siddikey, M Roni, A Kumer, U Chakma, M Matin Current Chemistry Letters 11 (3), 309-320, 2022 | 14 | 2022 |
A computational investigation of electronic structure and optical properties of AlCuO2 and AlCu0. 96Fe0. 04O2: a first principle approach MT Islam, A Kumer, U Chakma, D Howlader Orbital: The Electronic Journal of Chemistry, 58-64, 2021 | 14 | 2021 |