Structural (monomer and dimer), wavefunctional, NCI analysis in aqueous phase, electronic and excited state properties in different solvent atmosphere of 3-{(E)-[(3, 4 … MM Julie, T Prabhu, E Elamuruguporchelvi, FB Asif, S Muthu, A Irfan Journal of Molecular Liquids 336, 116335, 2021 | 54 | 2021 |
DFT, spectroscopic, DSC/TGA, electronic, biological and molecular docking investigation of 2, 5-thiophenedicarboxylic acid: A promising anticancer agent SS Margreat, S Ramalingam, S Sebastian, S Xavier, S Periandy, ... Journal of Molecular Structure 1200, 127099, 2020 | 33 | 2020 |
An antipsychotic drug: spectroscopic identification, structural features, DFT computations and molecular docking studies on 4-(methylamino)-3-nitrobenzoic acid MM Julie, T Prabhu, SS Margreat, DR Leenaraj, S Periandy, S Muthu, ... Journal of Molecular Structure 1196, 33-41, 2019 | 8 | 2019 |
In silico drug evaluation and drug research of bioactive molecule methyl 4-bromo-2-fluorobenzoate M Julie, T Prabhu, FB Asif, S Muthu Journal of Faculty of Pharmacy of Ankara University 45 (2), 284-296, 2021 | 7 | 2021 |