Structural insight into conformational dynamics of non-active site mutations in KasA: A Mycobacterium tuberculosis target protein M Jayaraman, SK Rajendra, K Ramadas Gene 720, 144082, 2019 | 34 | 2019 |
Virtual screening assisted discovery of novel natural products to inhibit the catalytic mechanism of Mycobacterium tuberculosis InhA M Jayaraman, L Loganathan, K Muthusamy, K Ramadas Journal of Molecular Liquids 335, 116204, 2021 | 30 | 2021 |
Structural perspective of ARHI mediated inhibition of STAT3 signaling: an insight into the inactive to active transition of ARHI and its interaction with STAT3 and importinβ K Muthu, M Panneerselvam, NS Topno, M Jayaraman, K Ramadas Cellular signalling 27 (4), 739-755, 2015 | 30 | 2015 |
Insight into the structural and functional analysis of the impact of missense mutation on cytochrome P450 oxidoreductase R Kumar, M Jayaraman, K Ramadas, A Chandrasekaran Journal of Molecular Graphics and Modelling 100, 107708, 2020 | 26 | 2020 |
Computational identification and analysis of deleterious non-synonymous single nucleotide polymorphisms (nsSNPs) in the human POR gene: a structural and … R Kumar, M Jayaraman, K Ramadas, A Chandrasekaran Journal of Biomolecular Structure and Dynamics 42 (3), 1518-1532, 2024 | 11 | 2024 |
An integrated computational investigation to unveil the structural impacts of mutation on the InhA structural gene of Mycobacterium tuberculosis M Jayaraman, K Ramadas Journal of Molecular Graphics and Modelling 101, 107768, 2020 | 11 | 2020 |
Molecular docking and simulation studies of gustatory receptor of Aedes aegypti: A potent drug target to distract host-seeking behaviour in mosquitoes KK Gupta, G Sethi, M Jayaraman Journal of vector borne diseases 53 (2), 179-184, 2016 | 8 | 2016 |
Differential gene expression analysis combined with molecular dynamics simulation study to elucidate the novel potential biomarker involved in pulmonary TB S Panchalingam, G Kasivelu, M Jayaraman, R Kumar, S Kalimuthu, ... Microbial Pathogenesis 182, 106266, 2023 | 7 | 2023 |
Computational insights into potential marine natural products as selective inhibitors of Mycobacterium tuberculosis InhA: a structure-based virtual screening study M Jayaraman, V Gosu, R Kumar, J Jeyaraman Computational Biology and Chemistry 108, 107991, 2024 | 4 | 2024 |
Crystallographic and DFT Studies on Pyrrolo[1,2‐c]imidazole Scaffolds M Jayaraman, R Balakrishnan, K Muthu, M Panneerselvam, ... Journal of Crystallography 2014 (1), 369061, 2014 | 4 | 2014 |
pH-Dependent conformational stability of SpeB from Thermus thermophilus HB8: insights from molecular dynamics simulation M Veerapandian, N Hemavathy, A Karthika, J Manikandan, U Vetrivel, ... Molecular Simulation 50 (3), 159-175, 2024 | 2 | 2024 |
Computational identification and molecular dynamics simulation of potential circularRNA derived peptide from gene expression profile of Rheumatoid arthritis, Alzheimer’s … S Panchalingam, G Kasivelu, M Jayaraman Journal of Biomolecular Structure and Dynamics 42 (15), 7699-7714, 2024 | 1 | 2024 |
Mechanistic insights into the conformational changes and alterations in residual communications due to the mutations in the pncA Gene of Mycobacterium tuberculosis: A … M Jayaraman, R Kumar, S Panchalingam, J Jeyaraman Computational Biology and Chemistry 110, 108065, 2024 | 1 | 2024 |
Computational modeling and molecular dynamic simulations of gold nanoparticles S Panchalingam, G Kasivelu, M Jayaraman Gold Nanoparticles, Nanomaterials and Nanocomposites, 869-893, 2025 | | 2025 |
Computational insights into marine natural products as potential antidiabetic agents targeting the SIK2 protein kinase domain K Heyram, J Manikandan, D Prabhu, J Jeyakanthan SAR and QSAR in Environmental Research 35 (12), 1129-1154, 2024 | | 2024 |
Harnessing marine natural products to inhibit PAD4 triple mutant: A structure-based virtual screening approach for rheumatoid arthritis therapy S Panchalingam, M Jayaraman, J Jeyaraman, G Kasivelu Archives of Biochemistry and Biophysics 761, 110164, 2024 | | 2024 |
Biochemical and biophysical characterization of biosynthetic arginine decarboxylase from Thermus thermophilus V Malaisamy, K Alagesan, H Nagarajan, M Jayaraman, U Vetrivel, ... Journal of Biomolecular Structure and Dynamics, 1-18, 2024 | | 2024 |
Homology Modeling, Molecular Dynamics Simulation and Essential Dynamics on Anopheles gambiae D7r1 C Goswami, M Jayraman, T Bakthavachalam, G Sethi, R Krishna | | 2017 |