| Synthesis, spectroscopic (FT-IR, FT-Raman, NMR, UV–Visible), NLO, NBO, HOMO-LUMO, Fukui function and molecular docking study of (E)-1-(5-bromo-2-hydroxybenzylidene) semicarbazide M Raja, RR Muhamed, S Muthu, M Suresh Journal of Molecular Structure 1141, 284-298, 2017 | 175 | 2017 |
| Investigations on 2-(4-Cyanophenylamino) acetic acid by FT-IR, FT-Raman, NMR and UV-Vis spectroscopy, DFT (NBO, HOMO-LUMO, MEP and Fukui function) and molecular docking studies MH Rahuman, S Muthu, BR Raajaraman, M Raja, H Umamahesvari Heliyon 6 (9), 2020 | 96 | 2020 |
| Molecular structure, spectroscopic (FT-IR, FT-Raman, NMR), HOMO-LUMO, chemical reactivity, AIM, ELF, LOL and Molecular docking studies on 1-Benzyl-4-(N-Boc-amino) piperidine S Janani, H Rajagopal, S Muthu, S Aayisha, M Raja Journal of Molecular Structure 1230, 129657, 2021 | 94 | 2021 |
| Spectroscopic (FT-IR, FT-Raman) investigation, topology (ESP, ELF, LOL) analyses, charge transfer excitation and molecular docking (dengue, HCV) studies on ribavirin S Muthu, JC Prasana, CS Abraham, M Raja Chemical Data Collections 17, 236-250, 2018 | 88 | 2018 |
| DFT, molecular docking and experimental FT-IR, FT-Raman, NMR inquisitions on “4-chloro-N-(4, 5-dihydro-1H-imidazol-2-yl)-6-methoxy-2-methylpyrimidin-5-amine”: alpha-2 … S Aayisha, TSR Devi, S Janani, S Muthu, M Raja, S Sevvanthi Journal of Molecular Structure 1186, 468-481, 2019 | 84 | 2019 |
| Synthesis, spectroscopic (FT-IR, FT-Raman, NMR, UV–Visible), first order hyperpolarizability, NBO and molecular docking study of (E)-1-(4-bromobenzylidene) semicarbazide M Raja, RR Muhamed, S Muthu, M Suresh Journal of Molecular Structure 1128, 481-492, 2017 | 84 | 2017 |
| Computational evaluation on molecular structure (Monomer, Dimer), RDG, ELF, electronic (HOMO-LUMO, MEP) properties, and spectroscopic profiling of 8-Quinolinesulfonamide with … F Basha, FLA Khan, S Muthu, M Raja Computational and Theoretical Chemistry 1198, 113169, 2021 | 76 | 2021 |
| Molecular docking, vibrational spectroscopy studies of (RS)-2-(tert-butylamino)-1-(3-chlorophenyl) propan-1-one: A potential adrenaline uptake inhibitor S Sevvanthi, S Muthu, M Raja Journal of Molecular Structure 1173, 251-260, 2018 | 75 | 2018 |
| Molecular structure interpretation, spectroscopic (FT-IR, FT-Raman), electronic solvation (UV–Vis, HOMO-LUMO and NLO) properties and biological evaluation of (2E)-3-(biphenyl-4 … A Thamarai, R Vadamalar, M Raja, S Muthu, B Narayana, P Ramesh, ... Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 226, 117609, 2020 | 65 | 2020 |
| PES, molecular structure, spectroscopic (FT-IR, FT-Raman), electronic (UV-Vis, HOMO-LUMO), quantum chemical and biological (docking) studies on a potent membrane permeable … S Sevvanthi, S Muthu, M Raja, S Aayisha, S Janani Heliyon 6 (8), 2020 | 58 | 2020 |
| Spectral, DFT and molecular docking investigations on Etodolac B Amul, S Muthu, M Raja, S Sevvanthi Journal of Molecular Structure 1195, 747-761, 2019 | 49 | 2019 |
| Thermal augmentation in parabolic trough collector solar water heater using rings attached twisted tapes RS Isravel, M Raja, S Saravanan, V Vijayan Materials Today: Proceedings 21, 127-129, 2020 | 42 | 2020 |
| Elaborated molecular structure, molecular docking and vibrational spectroscopic investigation of N-((4-aminophenyl) sulfonyl) benzamide with Density functional theory F Basha, FLA Khan, S Muthu, M Raja Chemical Data Collections 31, 100609, 2021 | 37 | 2021 |
| Spectroscopic (FT-IR, FT-Raman and UV-Vis), computational (ELF, LOL, NBO, HOMO-LUMO, Fukui, MEP) studies and molecular docking on benzodiazepine derivatives-heterocyclic … S Sevvanthi, S Muthu, S Aayisha, P Ramesh, M Raja Chemical Data Collections 30, 100574, 2020 | 36 | 2020 |
| Quantum computational, spectroscopic and molecular docking studies on 2-acetylthiophene and its bromination derivative MH Rahuman, S Muthu, BR Raajaraman, M Raja Journal of Molecular Structure 1212, 128129, 2020 | 32 | 2020 |
| Spectroscopic and DFT studies, structural determination, chemical properties and molecular docking of 1-(3-bromo-2-thienyl)-3-[4-(dimethylamino)-phenyl] prop-2-en-1-one P Ramesh, ML Caroline, S Muthu, B Narayana, M Raja, S Aayisha Journal of Molecular Structure 1200, 127123, 2020 | 32 | 2020 |
| Effect of helical fins on the performance of a double pipe heat exchanger S Sivalakshmi, M Raja, G Gowtham Materials Today: Proceedings 43, 1128-1131, 2021 | 31 | 2021 |
| Molecular structure, vibrational spectra, NBO, Fukui function, HOMO-LUMO analysis and molecular docking study of 6-[(2-methylphenyl) sulfanyl]-5-propylpyrimidine-2, 4 (1H, 3H … H AlRabiah, S Muthu, F Al-Omary, AM Al-Tamimi, M Raja, RR Muhamed, ... Macedonian Journal of Chemistry and Chemical Engineering 36 (1), 59-80, 2017 | 30 | 2017 |
| Molecular structure, spectroscopic (FT-IR, FT-Raman, NMR, UV-VIS), chemical reactivity and biological examinations of Ketorolac B Amul, S Muthu, M Raja, S Sevvanthi Journal of Molecular Structure 1210, 128040, 2020 | 28 | 2020 |
| Quantum mechanical, spectroscopic studies and molecular docking analysis on 5, 5-diphenylimidazolidine-2, 4-dione S Sevvanthi, S Muthu, M Raja Journal of Molecular Structure 1149, 487-498, 2017 | 28 | 2017 |
