| Purification of fucoxanthin from Sargassum wightii Greville and understanding the inhibition of angiotensin 1-converting enzyme: An in vitro and in silico studies V Raji, C Loganathan, G Sadhasivam, S Kandasamy, K Poomani, ... International journal of biological macromolecules 148, 696-703, 2020 | 39 | 2020 |
| Exploring the binding interaction mechanism of taxol in β-tubulin and bovine serum albumin: A biophysical approach S Karthikeyan, G Bharanidharan, S Ragavan, S Kandasamy, ... Molecular pharmaceutics 16 (2), 669-681, 2019 | 37 | 2019 |
| Understanding the conformational flexibility and electrostatic properties of curcumin in the active site of rhAChE via molecular docking, molecular dynamics, and charge density … K Saravanan, C Kalaiarasi, P Kumaradhas Journal of Biomolecular Structure and Dynamics 35 (16), 3627-3647, 2017 | 30 | 2017 |
| Comparative Binding Analysis of N-Acetylneuraminic Acid in Bovine Serum Albumin and Human α-1 Acid Glycoprotein S Karthikeyan, G Bharanidharan, S Ragavan, S Kandasamy, ... Journal of chemical information and modeling 59 (1), 326-338, 2018 | 29 | 2018 |
| Investigation of intermolecular interactions and stability of verubecestat in the active site of BACE1: Development of first model from QM/MM-based charge density and MD analysis K Saravanan, M Sivanandam, G Hunday, L Mathiyalagan, P Kumaradhas Journal of Biomolecular Structure and Dynamics 37 (9), 2339-2354, 2019 | 23 | 2019 |
| A cytotoxicity, optical spectroscopy and computational binding analysis of 4‐[3‐acetyl‐5‐(acetylamino)‐2‐methyl‐2, 3‐dihydro‐1, 3, 4‐thiadiazole‐2‐yl] phenyl benzoate in calf … S Karthikeyan, G Bharanidharan, R Mangaiyarkarasi, S Chinnathambi, ... Luminescence 33 (4), 731-741, 2018 | 20 | 2018 |
| Flexible organic crystals. Understanding the tractable co-existence of elastic and plastic bending IS Divya, S Kandasamy, S Hasebe, T Sasaki, H Koshima, K Woźniak, ... Chemical Science 13 (31), 8989-9003, 2022 | 18 | 2022 |
| In silico, theoretical biointerface analysis and in vitro kinetic analysis of amine compounds interaction with acetylcholinesterase and butyrylcholinesterase S Kandasamy, C Loganathan, P Sakayanathan, S Karthikeyan, ... International Journal of Biological Macromolecules 185, 750-760, 2021 | 16 | 2021 |
| Design and synthesis of imidazole based zinc binding groups as novel small molecule inhibitors targeting Histone deacetylase enzymes in lung cancer S Kandasamy, P Subramani, K Srinivasan, J marshal Jayaraj, G Prasanth, ... Journal of Molecular Structure 1214, 128177, 2020 | 16 | 2020 |
| Topological and electrostatic properties of diclofenac molecule as a non-steroidal anti-inflammatory drug: An experimental and theoretical study RN Devi, AD Stephen, P Justin, K Saravanan, P Macchi, C Jelsch Journal of Molecular Structure 1196, 42-53, 2019 | 15 | 2019 |
| In vitro and in silico analysis of novel astaxanthin-s-allyl cysteine as an inhibitor of butyrylcholinesterase and various globular forms of acetylcholinesterases P Sakayanathan, C Loganathan, S Kandasamy, RV Ramanna, ... International journal of biological macromolecules 140, 1147-1157, 2019 | 15 | 2019 |
| Molecular modelling and dynamic simulation of UDP-N-acetylglucosamine 1-carboxyvinyltransferase (MurA) from Mycobacterium tuberculosis using in silico approach MA Isa, RS Majumdar, S Haider, S Kandasamy Informatics in Medicine Unlocked 12, 56-66, 2018 | 14 | 2018 |
| Self-assembly of new cobalt complexes based on [Co (SCN)4], synthesis, empirical, antioxidant activity, and quantum theory investigations A Ferchichi, J Makhlouf, Y El Bakri, K Saravanan, A Valkonen, ... Scientific Reports 12 (1), 15828, 2022 | 13 | 2022 |
| Binding and stability of indirubin-3-monoxime in the GSK3β enzyme: a molecular dynamics simulation and binding free energy study K Saravanan, G Hunday, P Kumaradhas Journal of Biomolecular Structure and Dynamics 37, 2019 | 12 | 2019 |
| Insights into intermolecular interactions, electrostatic properties and the stability of C646 in the binding pocket of p300 histone acetyltransferase enzyme: a combined … M Sivanandam, K Saravanan, P Kumaradhas Journal of Biomolecular Structure and Dynamics 36 (12), 3246-3264, 2018 | 12 | 2018 |
| 1, 4, 9, 9-tetramethyloctahydro-4, 7-(epoxymethano) azulen-5 (1H)-one, a natural product as a potential inhibitor of COVID-19: Extraction, crystal structure, and virtual … Y El Bakri, SK Mohamed, K Saravanan, S Ahmad, AA Mahmoud, ... Journal of King Saud University-Science 35 (4), 102628, 2023 | 11 | 2023 |
| Inhibition of glutathione and s-allyl glutathione on pancreatic lipase: Analysis through in vitro kinetics, fluorescence spectroscopy and in silico docking P Thayumanavan, S Nallaiyan, C Loganathan, P Sakayanathan, ... International Journal of Biological Macromolecules 160, 623-631, 2020 | 11 | 2020 |
| Acylguanidine-BACE1 complex: Insights of intermolecular interactions and dynamics K Saravanan, P Kumaradhas Journal of Theoretical Biology 464, 33-49, 2019 | 11 | 2019 |
| Growth, single crystal investigations, hirshfeld surface analysis, DFT studies, molecular dynamics simulations, molecular docking, physico-chemical characterization and … J Makhlouf, Y El Bakri, A Valkonen, K Saravanan, S Ahmad, W Smirani Polyhedron 222, 115937, 2022 | 10 | 2022 |
| Strong binding of leupeptin with TMPRSS2 protease may be an alternative to camostat and nafamostat for SARS-CoV-2 repurposed drug: Evaluation from molecular docking and … J Ramakrishnan, S Kandasamy, A Iruthayaraj, S Magudeeswaran, ... Applied Biochemistry and Biotechnology 193 (6), 1909-1923, 2021 | 10 | 2021 |
Kumaradhas PoomaniProfessor and Head, Department of Physics, Periyar UniversityVerified email at periyaruniversity.ac.in
