FT-IR, FT-Raman spectra and ab initio HF and DFT calculations of 7-chloro-5-(2-chlorophenyl)-3-hydroxy-2, 3-dihydro-1H-1, 4-benzodiazepin-2-one S Muthu, M Prasath, EI Paulraj, RA Balaji Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 120, 185-194, 2014 | 27 | 2014 |
Exploring the molecular structure, vibrational spectroscopic, quantumchemical calculation and molecular docking studies of curcumin: A potentialPI3K/AKT uptake inhibitor MS M. Govindammal, M. Prasath, S. Kamaraj, S. Muthu Heliyon 7 (4), E06646, 2021 | 22 | 2021 |
Probing the vibrational spectroscopic properties and binding mechanism of anti-influenza agent Liquiritin using experimental and computational studies B Sathya, S Karthi, K Ajaijawahar, M Prasath Research on Chemical Intermediates 46, 4475-4507, 2020 | 21 | 2020 |
Effect of NaCl on the properties of sulphamic acid single crystals J Arumugam, N Suresh, M Selvapandiyan, S Sudhakar, M Prasath Heliyon 5 (7), 2019 | 21 | 2019 |
Spectroscopic investigations, quantum chemical calculations and molecular docking studies of Mangiferin-an anti-viral agent of H1N1 Influenza virus S Bangaru, P Manivannan, S Muthu Chemical Data Collections 30, 100580, 2020 | 20 | 2020 |
Vibrational spectra, Hirshfeld surface analysis, molecular docking studies of (RS)-N,N-bis(2-chloroethyl)-1,3,2-oxazaphosphinan-2-amine 2-oxide by DFT approach MP M.Govindammal Heliyon 6 (8), e04641, 2020 | 20 | 2020 |
Spectroscopic (FT-IR, FT-Raman, UV–Vis), quantum chemical calculation and molecular docking evaluation of liquiritigenin: an influenza A (H1N1) neuraminidase inhibitor B Sathya, M Prasath Research on Chemical Intermediates 45, 2135-2166, 2019 | 20 | 2019 |
Invivo, molecular docking, spectroscopy studies of (S)-2, 3-Dihydro-5, 7-dihydroxy-2 (3-hydroxy-4-methoxyphenyl)-4H-1-benzopyran-4-one: A potential uptake PI3/AKT inhibitor M Govindammal, M Prasath, S Kamaraj, B Sathya Biocatalysis and Agricultural Biotechnology 18, 101086, 2019 | 20 | 2019 |
Experimental and theoretical investigations of spectroscopic properties of 8-chloro-1-methyl-6-phenyl-4H-[1, 2, 4] triazolo [4, 3-a][1, 4] benzodiazepine S Muthu, M Prasath, RA Balaji Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 106, 129-145, 2013 | 20 | 2013 |
Quantum chemical studies, vibrational analysis, molecular structure, first order hyper polarizability, NBO and HOMO–LUMO analysis of 3-hydroxybenzaldehyde and its cation MP S. Muthu Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 2013 | 20 | 2013 |
Vibrational spectroscopy investigation using ab initio and DFT vibrational analysis of 7-chloro-2-methylamino-5-phenyl-3H-1, 4-benzodiazepine-4-oxide M Prasath, S Muthu, RA Balaji Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 113, 224-235, 2013 | 19 | 2013 |
Spectroscopic (FT-IR, FT-Raman, NMR and UV–visible), ADMET and molecular docking investigation of aztreonam as anti-tuberculosis agent N Mani, S Suresh, M Govindammal, S Kannan, EI Paulraj, ... Chemical Physics Impact 7, 100254, 2023 | 18 | 2023 |
Vibrational analysis (FT-IR and FT-Raman spectra) and molecular docking evaluation of MPTB in GABA receptor B Sathya, M Prasath, M Selvapandiyan, K Prabha Journal of Cluster Science 30, 1025-1035, 2019 | 18 | 2019 |
Synthesis chemical methods for deposition of ZnO, CdO and CdZnO thin films to facilitate further research B Amudhavalli, R Mariappan, M Prasath Journal of Alloys and Compounds 925, 166511, 2022 | 17 | 2022 |
Spectroscopic investigations (FT-IR & FT-Raman) and molecular docking analysis of 6-[1-methyl-4-nitro-1H-imidazol-5-yl) sulfonyl]-7H-purine M Prasath, M Govindammal, B Sathya Journal of Molecular Structure 1146, 292-300, 2017 | 16 | 2017 |
Quantum chemical calculations, spectroscopic studies and molecular docking investigations of the anti-cancer drug quercitrin with B-RAF inhibitor M Govindammal, S Kannan, P Srinivasan, M Prasath Heliyon 8 (5), 2022 | 13 | 2022 |
Donor functionalized perylene and different π‐spacer based sensitizers for dye‐sensitized solar cell applications — a theoretical approach PPMP D. Nicksonsebastin Journal of Molecular Modeling 28 (102), 1-18, 2022 | 12 | 2022 |
Probing the structural properties, binding mode and intermolecular interactions of herbacetin against H1N1 neuraminidase using vibrational spectroscopic, quantum chemical … SBP Manivannan Research on Chemical Intermediates 47, 2775–2799, 2021 | 12 | 2021 |
Silver nanoparticles as a non alcoholic hospital disinfectant to combat nosocomial pathogens G Anjana, M Gowri, CS Raja, M Prasath, S Balakumar, V Ganesh Journal of Bionanoscience 9 (2), 102-111, 2015 | 12 | 2015 |
Potential energy surface, effect of solvents in molecular level, experimental spectra (FTIR, Raman, UV–visible & NMR), electronic, and dynamics simulation of isobavachalcone … N Mani, D Nicksonsebastin, M Prasath, JNC Mishma, S Kadaikunnan, ... Journal of Molecular Liquids 392, 123465, 2023 | 11 | 2023 |