| Benzimidazole based Pt(II) complexes with better normal cell viability than cisplatin: synthesis, substitution behavior, cytotoxicity, DNA binding and DFT study I Mitra, S Mukherjee, VP Reddy B., S Dasgupta, JC Bose K, S Mukherjee, ... RSC Advances 6, 76600–76613, 2016 | 61 | 2016 |
| Synthesis, biological evaluation, substitution behaviour and DFT study of Pd (II) complexes incorporating benzimidazole derivative I Mitra, S Mukherjee, B Misini, P Das, S Dasgupta, W Linert, SC Moi New Journal of Chemistry 42 (4), 2574-2589, 2018 | 40 | 2018 |
| Logic gate-based Rhodamine-methionine conjugate highly sensitive fluorescent probe for Hg2+ ion and its application: An experimental and theoretical study A Sikdar, S Roy, S Dasgupta, S Mukherjee, SS Panja Sensors and Actuators B: Chemical 263, 298-311, 2018 | 34 | 2018 |
| Structural insight to hydroxychloroquine-3C-like proteinase complexation from SARS-CoV-2: inhibitor modelling study through molecular docking and MD-simulation study S Mukherjee, S Dasgupta, T Adhikary, U Adhikari, SS Panja Journal of Biomolecular Structure and Dynamics 39 (18), 7322-7334, 2021 | 26 | 2021 |
| Recognition dynamics of dopamine to human Monoamine oxidase B: role of Leu171/Gln206 and conserved water molecules in the active site cavity S Dasgupta, S Mukherjee, BP Mukhopadhyay, A Banerjee, DK Mishra Journal of Biomolecular Structure and Dynamics, 2017 | 17 | 2017 |
| The putative role of some conserved water molecules in the structure and function of human transthyretin A Banerjee, S Dasgupta, BP Mukhopadhyay, K Sekar Acta Crystallographica Section D: Biological Crystallography 71 (11), 2248-2266, 2015 | 13 | 2015 |
| Cytotoxic, DNA binding and drug reservoir property of Pt(II)–sulfur complexes: In-vitro kinetics, mechanism with bio-relevant molecules in aqueous medium and a theoretical approach S Mukherjee, I Mitra, VP Reddy B., S Mahata, JC Bose K., S Dasgupta, ... Polyhedron 119, 84–97, 2016 | 12 | 2016 |
| Corrosion inhibition of mild steel by aqueous leaf extract of purple hedge plant: experimental and theoretical investigation S Mukhopadhyay, S Dasgupta, S Roy, A Mondal, D Sukul, S Ghosal, ... Journal of Bio-and Tribo-Corrosion 7 (4), 139, 2021 | 9 | 2021 |
| The conformational dynamics of wing gates Ile199 and Phe103 on the binding of dopamine and benzylamine substrates in human monoamine Oxidase B S Dasgupta, S Mukherjee, K Sekar, BP Mukhopadhyay Journal of Biomolecular Structure and Dynamics 39 (5), 1879-1886, 2021 | 4 | 2021 |
| Recognition of trans and gauche phenylethylamine conformers in the active site of human monoamine oxidase B: A MD-simulation and DFT studies S Dasgupta, S Mukherjee, BP Mukhopadhyay Computational and Theoretical Chemistry 1127, 44-51, 2018 | 4 | 2018 |
| Molecular modeling and molecular dynamics simulation studies on thyroid hormone receptor from Rattus norvegicus: role of conserved water molecules S Mukherjee, S Dasgupta, U Adhikari, SS Panja Journal of Molecular Modeling 27, 1-14, 2021 | 2 | 2021 |
| Structural insight to human Retinoid X receptor alpha-Thyroid hormone receptor beta heterodimer by molecular modelling and MD-simulation studies: role of conserved water molecules S Mukherjee, S Dasgupta, SS Panja, U Adhikari Journal of Biomolecular Structure and Dynamics 41 (19), 9828-9839, 2023 | 1 | 2023 |
| A comparative theoretical investigation on the hydride transfer process of trans and gauche conformers of phenylethylamine and norepinephrine with lumiflavin S Dasgupta, S Mukherjee, BP Mukhopadhyay JOURNAL OF THE INDIAN CHEMICAL SOCIETY 97 (11 A), 2300-2310, 2020 | | 2020 |
| A comparative computational study for deamination of trans and gauche conformers of phenylethylamine in presence of lumiflavin S Dasgupta, S Mukherjee, BP Mukhopadhyay JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS 37, 17-17, 2019 | | 2019 |
| MODELING OF TYPE I AND II HIMPDH (HUMAN INOSINE MONOPHOSPHATE DEHYDROGENASE) HOMOTETRAMERIC STRUCTURE BY MOLECULAR DYNAMICS METHODS DK MISHRA, S DASGUPTA, BP MUKHOPADHYAY, S MUKHERJEE Int J Pharm Bio Sci 7 (2), 264 - 271, 2016 | | 2016 |
| CONSERVED WATER MIMIC INHIBITOR DESIGN FOR hIMPDH (INOSINE MONOPHOSPHATE DEHYDROGENASE): MD SIMULATION AND DOCKING STUDIES OF IMP-ANALOGS DK Mishra, BP Mukhopadhyay, A Banerjee, S Dasgupta International Journal of Pharmaceutical Sciences and Research 5 (10), 4414-4423, 2014 | | 2014 |
Bishnu Prasad MukhopadhyayProfessor of Chemistry, National Institute of Technology-DurgapurVerified email at ch.nitdgp.ac.in
