Kumaradhas Poomani
Periyar University
H-index: 22
Asia-India
Top articles of Kumaradhas Poomani
Title | Journal | Author(s) | Publication Date |
|---|---|---|---|
Synthesis, DFT, in-silico molecular docking, molecular dynamic simulation and ADMET studies of (Z)-2,6-bis(4-bromophenyl)-3,3-dimethyl-4-(2-(2,4,6 … | Zeitschrift für Physikalische Chemie | Solo Lorin Rajaraman Dhanakotti Sonadevi Selvam Ramakrishnan Jaganathan Poomani Kumaradhas | 2024/3/4 |
Binding properties of selective inhibitors of P323L mutated RdRp of SARS-CoV-2: a combined molecular screening, docking and dynamics simulation study | Journal of Biomolecular Structure and Dynamics | Archana Chinnamadhu Jaganathan Ramakrishnan Suganya Suresh Kumaradhas Poomani | 2023/5/28 |
Crystal structure, intermolecular interactions, charge–density distribution and ADME properties of the acridinium 4-nitrobenzoate and 2-amino-3-methylpyridinium 4-nitrobenzoate … | Chemical Data Collections | Balasubramanian Hemalatha Suganya Suresh Kumaradhas Poomani | 2023/12/1 |
N'-(3, 4-dimethoxybenzylidene)-4-methylbenzenesulfonohydrazide derivatives: Synthesis, quantum chemical method, in silico ADMET, molecular docking and molecular dynamic simulations | Journal of Molecular Structure | Solo Lorin L Athishu Anthony R Jaganathan P Kumaradhas D Rajaraman | 2023/11/5 |
Investigation on anticancer activity of new Ni (II) cuminaldehyde based benzhydrazone complexes | Inorganica Chimica Acta | Prabaharan Ramya Rengan Ramesh Poomani Kumaradhas | 2023/2/1 |
The effect of genotype variation and M423 resistance mutations to the binding of phosphonomidate-based inhibitor IDX17119 with the thumb-II domain of Hepatitis C virus RdRp: an … | Molecular Simulation | Saravanan Manjula Chinnasamy Kalaiarasi Ramakrishnan Jaganathan Poomani Kumaradhas | 2023/1/22 |
Evaluation of binding affinities of anacardic acid and D-12 molecules in the active site of p300 HAT enzyme from Molecular docking and Molecular dynamics simulation analysis | Sivanandam Magudeeswaran Kumaradhas Poomani | 2023/9/14 | |
Lawsonia inermis flower aqueous extract expressed better anti-alpha-glucosidase and anti-acetylcholinesterase activity and their molecular dynamics | Journal of Biomolecular Structure and Dynamics | Ismail Shahanaj Jaganathan Ramakrishnan Kumaradhas Poomani Natarajan Devarajan | 2023/12/29 |
Probing the binding nature and stability of highly transmissible mutated variant alpha to omicron of SARS‐CoV‐2 RBD with ACE2 via molecular dynamics simulation | Journal of Cellular Biochemistry | Jaganathan Ramakrishnan Archana Chinnamadhu Suganya Suresh Kumaradhas Poomani | 2023/8 |
Dynamics and binding affinity of nucleoside and non-nucleoside inhibitors with RdRp of SARS-CoV-2: a molecular screening, docking, and molecular dynamics simulation study | Journal of Biomolecular Structure and Dynamics | Archana Chinnamadhu Jaganathan Ramakrishnan Suganya Suresh Prakash Ramadurai Kumaradhas Poomani | 2023/12/21 |
Binding mechanism of anacardic acid, carnosol and garcinol with PCAF: A comprehensive study using molecular docking and molecular dynamics simulations and binding free energy … | Journal of Cellular Biochemistry | Ramakrishnan Jaganathan Poomani Kumaradhas | 2023/5 |
Synthesis, quantum chemical studies, molecular docking, molecular dynamics simulation and ADMET studies on 2-(2, 3-dihydrobenzo [b][1, 4] dioxin-6-yl)-1, 4, 5-triphenyl-1 H … | Molecular Physics | Solo Lorin D Rajaraman S Sonadevi R Jaganathan P Kumaradhas | 2023/12/20 |
Investigation of intermolecular interactions and binding mechanism of PU139 and PU141 molecules with p300 HAT enzyme via molecular docking, molecular dynamics simulations and … | Journal of Biomolecular Structure and Dynamics | Jaganathan Ramakrishnan Sivanandam Magudeeswaran Suganya Suresh Kumaradhas Poomani | 2023/3/4 |
Phytochemical profiling, human insulin stability and alpha glucosidase inhibition of Gymnema latifolium leaves aqueous extract: Exploring through experimental and in silico … | Computational Biology and Chemistry | Shahanaj Ismail Tajalli Ilm Chandel Jaganathan Ramakrishnan Rizwan Hasan Khan Kumaradhas Poomani | 2023/12/1 |
Halogen-based 17β-HSD1 inhibitors: insights from DFT, docking, and molecular dynamics simulation studies | Molecules | Arulsamy Kulandaisamy Murugesan Panneerselvam Rajadurai Vijay Solomon Madhavan Jaccob Jaganathan Ramakrishnan | 2022/6/20 |
Insights on structure and interactions of 2-amino-4-methoxy-6-methylpyrimidinium salts with 4-aminosalicylate and 5-chlorosalicylate: a combined experimental and theoretical … | Acta Crystallographica Section C: Structural Chemistry | Suganya Suresh Saravanan Kandasamy Hemalatha Balasubramanian K Poomani | 2022/3/1 |
Probing the intermolecular interactions, binding affinity, charge density distribution and dynamics of silibinin in dual targets AChE and BACE1: QTAIM and molecular dynamics … | Journal of Biomolecular Structure and Dynamics | Kandasamy Saravanan Srinivasan Sugarthi Suresh Suganya Poomani Kumaradhas | 2022/12/19 |
Synthesis, Characterization, Crystal structure of 4-(4-Bromo-phenyl)-2, 6-dimethyl-1, 4-dihydro-pyridine-3, 5-dicarboxylic acid diethyl ester: Hirshfeld surface analysis and … | Egyptian Journal of Chemistry | D Parthasarathi M Syed Ali Padusha S Suganya P Kumaradhas Ayyiliath M Sajith | 2022/2/1 |
Gelatin/polyvinyl alcohol loaded magnesium hydroxide nanocomposite attenuates neurotoxicity and oxidative stress in Alzheimer's disease induced rats | International Journal of Biological Macromolecules | Manickam Rajkumar Karuppaiya Vimala Darwin Dasan Tamiliniyan Ramasundaram Thangaraj Ramakrishnan Jaganathan | 2022/12/1 |
Synthesis, crystal structure, Hirshfeld surface analysis, DFT, molecular docking and molecular dynamic simulation studies of (E)-2, 6-bis (4-chlorophenyl)-3-methyl-4-(2-(2, 4 … | Heliyon | KM Chandini MJ Nagesh Khadri N Amoghavarsha MA Sridhar Shaukath Ara Khanum | 2022/8/1 |
