Synthesis, crystal structure analysis, spectral investigations (NMR, FT-IR, UV), DFT calculations, ADMET studies, molecular docking and anticancer activity of 2-(1-benzyl-5 … S Murugavel, C Ravikumar, G Jaabil, P Alagusundaram Journal of Molecular Structure 1176, 729-742, 2019 | 59 | 2019 |
Synthesis, computational quantum chemical study, in silico ADMET and molecular docking analysis, in vitro biological evaluation of a novel sulfur heterocyclic thiophene … S Murugavel, C Ravikumar, G Jaabil, P Alagusundaram Computational Biology and Chemistry 79, 73-82, 2019 | 43 | 2019 |
A chiral (1R,2R)-N,N′-bis-(salicylidene)-1,2-diphenyl-1,2-ethanediamine Schiff base dye: synthesis, crystal structure, Hirshfeld surface analysis, computational … AA Shiryaev, AN Goncharenko, TM Burkhanova, LE Alkhimova, ... Journal of the Iranian Chemical Society 18, 2897-2911, 2021 | 23 | 2021 |
Synthesis, structural, spectral and antibacterial activity of 3, 3a, 4, 5-tetrahydro-2H-benzo [g] indazole fused carbothioamide derivatives as antibacterial agents S Murugavel, S Deepa, C Ravikumar, R Ranganathan, P Alagusundaram Journal of Molecular Structure 1222, 128961, 2020 | 13 | 2020 |
Crystal structure, Hirshfeld, computational biomolecular investigations, and MTT assay studies of amino pyrimidine derivative as EGFR kinase domain inhibitor RK Chandrasekaran, S Murugavel, M Guin, T Silambarasan Journal of Molecular Structure 1254, 132416, 2022 | 11 | 2022 |
Synthesis, structural, DFT investigations and antibacterial activity assessment of pyrazoline‐thiocyanatoethanone derivatives as thymidylate kinase inhibitors M Saminathan, S Kanagarajan, R Chandrasekaran, A Sivasubramaniyan, ... Journal of the Chinese Chemical Society 67 (6), 1100-1112, 2020 | 11 | 2020 |
A Green and Efficient Synthesis of Bioactive 1, 2, 3 ‐ Triazolyl‐Pyridine/Cyanopyridine Hybrids via One‐Pot Multicomponent Grinding Protocol G Jaabil, R Ranganathan, A Ponnuswamy, P Suresh, V Shanmugaiah, ... ChemistrySelect 3 (37), 10388-10393, 2018 | 7 | 2018 |
Eco-technological method for carbon dioxide biosorption and molecular mechanism of the RuBisCO enzyme from unicellular microalga Chlorella vulgaris RDS03 … ST Selvan, R Chandrasekaran, S Muthusamy, S Balasundaram, ... Biomass Conversion and Biorefinery 14 (3), 4191-4209, 2024 | 6 | 2024 |
Eco-friendly approach for tannery effluent treatment and CO2 sequestration using unicellular green oleaginous microalga Tetradesmus obliquus TS03 ST Selvan, R Chandrasekaran, S Muthusamy, D Ramamurthy Environmental Science and Pollution Research 30 (16), 48138-48156, 2023 | 6 | 2023 |
Integrating eco-technological approach for textile dye effluent treatment and carbon dioxide capturing from unicellular microalga Chlorella vulgaris RDS03: a … S Tamil Selvan, BM Dakshinamoorthi, R Chandrasekaran, S Muthusamy, ... International Journal of Phytoremediation 25 (4), 466-482, 2023 | 6 | 2023 |
Synthesis, crystal structure elucidation, DFT analysis, drug‐likeness and ADMET evaluation and molecular docking studies of triazole derivatives: Binary inhibition of spike … S Murugavel, P Vasudevan, RK Chandrasekaran, V Archana, ... Journal of the Chinese Chemical Society 69 (6), 884-900, 2022 | 6 | 2022 |
Synthesis, spectral, crystal structure, drug‐likeness, in silico, and in vitro biological screening of halogen [Cl, Br] substituted N‐phenylbenzo[g]indazole derivatives … M Saminathan, MR Jayakumar, R Chandrasekaran, R Raja, J George, ... Journal of Heterocyclic Chemistry 58 (3), 841-863, 2021 | 6 | 2021 |
Crystal structure determination, hirshfeld surface analysis and quantum computational studies of (3E, 5E)-1-ethyl-3, 5-bis (naphthalen-1-yl-methylidene) piperidin-4-one: A … R Swamy, C Ravikumar Journal of Molecular Structure 1225, 129313, 2021 | 6 | 2021 |
Computer Aided Drug Design of 1, 2, 3-Triazole Fused Bioactive Derivative Targeting Glucosamine-6-Phosphate Synthase (GlmS)–XRD, Computational Crystallography, and Molecular … RK Chandrasekaran, S Murugavel, T Silambarasan Polycyclic Aromatic Compounds 43 (4), 3223-3239, 2023 | 5 | 2023 |
Modeling and dynamic design of an artificial culture medium for heterotrophic cultivation of Tetradesmus obliquus RDS01 for CO2 sequestration and green biofuels production: an … ST Selvan, S Muthusamy, R Chandrasekaran, D Ramamurthy, ... Biomass Conversion and Biorefinery, 1-23, 2022 | 4 | 2022 |
Quantum, Hirshfeld surface, crystal voids, energy framework and molecular docking analysis of two halogen-containing benzimidazole-2-thione structures M Singh, S Murugavel, R Chandrasekaran, R Kant Molecular Crystals and Liquid Crystals 739 (1), 127-141, 2022 | 3 | 2022 |
Crystal structure, quantum computational, molecular docking and in vitro anti-proliferative investigations of 1H‐imidazole‐2‐thione analogues derivative C Ravikumar, ST Selvan, M Saminathan, DA Safin Journal of Molecular Structure 1250, 131833, 2022 | 3 | 2022 |
Structural correlation and computational quantum chemical explorations of two 1, 2, 3-triazolyl-methoxypyridine derivatives as CYP51 antifungal inhibitors C Ravikumar, S Murugavel Structural Chemistry 30 (6), 2225-2243, 2019 | 3 | 2019 |
Synthesis, X-ray structure and molecular docking analysis of two novel 1, 2, 4, 5-tetrasubstituted imidazole derivatives R Sharma, A Jayashree, B Narayana, BK Sarojini, C Ravikumar, ... International Journal of Biophysics 8 (1), 9-15, 2018 | 3 | 2018 |
Synthesis, quantum chemical, and molecular modeling investigations of 1, 2, 3‐triazole fused dicarboxylate bioorganic derivative as angiotensin‐converting enzyme inhibitor RK Chandrasekaran, S Murugavel, T Silambarasan Journal of the Chinese Chemical Society 69 (3), 569-584, 2022 | 1 | 2022 |