| Investigation of structural analogs of hydroxychloroquine for SARS-CoV-2 main protease (Mpro): A computational drug discovery study S Reyaz, A Tasneem, GP Rai, HR Bairagya Journal of Molecular Graphics and Modelling 109, 108021, 2021 | 11 | 2021 |
| Structural and dynamical impact of water molecules at substrate-or product-binding sites in human GMPR enzyme: a study by molecular dynamics simulations HR Bairagya, A Tasneem, GP Rai, S Reyaz The Journal of Physical Chemistry B 125 (5), 1351-1362, 2020 | 5 | 2020 |
| The possible molecular mechanism of SARS-CoV-2 Main Protease: new structural insights from computational methods A Tasneem, GP Rai, S Reyaz, HR Bairagya SciMedicine Journal 2, 108-126, 2021 | 4 | 2021 |
| Coevolution based immunoinformatics approach considering variability of epitopes to combat different strains: A case study using spike protein of SARS-CoV-2 SK Mishra, P Priya, GP Rai, R Haque, A Shanker Computers in Biology and Medicine 163, 107233, 2023 | 2 | 2023 |
| New biochemical insights into the dynamics of water molecules at the GMP or IMP binding site of human GMPR enzyme: A molecular dynamics study HR Bairagya, A Tasneem, GP Rai, S Reyaz Proteins: Structure, Function, and Bioinformatics 90 (1), 200-217, 2022 | 2 | 2022 |
| Coevolution-based computational approach to detect resistance mechanism of epidermal growth factor receptor GP Rai, A Shanker Biochimica et Biophysica Acta (BBA)-Molecular Cell Research 1871 (1), 119592, 2024 | | 2024 |
| A New Approach for Understanding the Mechanism and Drug Design of Chronic Myeloid Leukemia Responsive Protein: An In-Silico Study for the Design of Isoform Specific Anti … HR Bairagya, GP Rai, A Tasneem, S Reyaz Eliva Press-Europe (ISBN: 978-1952751516), 2020 | | 2020 |
| Understanding the mechanism of CML cancer proteins: A computational study towards the design of anticancer agent A Tasneem, GP Rai, S Reyaz IILM Sustainability Carnival and PRME Conference 2020, IILM Academy of …, 2019 | | 2019 |
| Role of conserved water molecules at GMP Binding site in Human GMP Reductase Enzyme: A Study by MD Simulation GP Rai, S Reyaz, A Tasneem, HR Bairagya Proceedings at International conference on Frontiers in Biochemistry and …, 2019 | | 2019 |
| Role of conserved water molecules at GMP Binding site in Human GMP Reductase Enzyme: A Study by MD Simulation GP Rai, S Reyaz, A Tasneem, HR Bairagya Proceedings at National Seminar on Bioinformatics: Concepts, Applications …, 2019 | | 2019 |
| Role of conserved water molecules at GMP binding domain in native conformation of human GMPR enzyme: A MD simulation study HR Bairagya, GP Rai, A Tasneem, S Reyaz Proceedings at National Workshop (9th) on Translational Bioinformatics …, 2019 | | 2019 |
| New Structural Insight of GMP Binding Domain in unliganded Conformation of human GMPR Enzyme: A MD simulation study GP Rai, HR Bairagya Proceedings at National Workshop (9th) on Translational Bioinformatics …, 2019 | | 2019 |
| SciMedicine Journal A Tasneem, GP Rai, S Reyaz, HR Bairagya | | |
Dr.Hridoy Ranjan BairagyaAssociate Professor, Department of Bioinformatics,Maulana Abul Kalam Azad University of TechnologyVerified email at makautwb.ac.in
