Molecular electrostatic potential analysis: A powerful tool to interpret and predict chemical reactivity CH Suresh, GS Remya, PK Anjalikrishna Wiley Interdisciplinary Reviews: Computational Molecular Science 12 (5), e1601, 2022 | 139 | 2022 |
Quantification and classification of substituent effects in organic chemistry: A theoretical molecular electrostatic potential study GS Remya, CH Suresh Physical Chemistry Chemical Physics 18 (30), 20615-20626, 2016 | 115 | 2016 |
Pincer Ligand Modifications To Tune the Activation Barrier for H2 Elimination in Water Splitting Milstein Catalyst KS Sandhya, GS Remya, CH Suresh Inorganic Chemistry 54 (23), 11150-11156, 2015 | 29 | 2015 |
Wiley Interdiscip CH Suresh, GS Remya, PK Anjalikrishna Rev.: Comput. Mol. Sci 12, 1-31, 2022 | 23 | 2022 |
Assessment of the electron donor properties of substituted phenanthroline ligands in molybdenum carbonyl complexes using molecular electrostatic potentials GS Remya, CH Suresh New Journal of Chemistry 42 (5), 3602-3608, 2018 | 19 | 2018 |
NADH-depletion triggered energy shutting with cyclometalated iridium (III) complex enabled bimodal Luminescence-SERS sensing and photodynamic therapy S Shamjith, MM Joseph, VP Murali, GS Remya, JB Nair, CH Suresh, ... Biosensors and Bioelectronics 204, 114087, 2022 | 15 | 2022 |
Extending the library of boron bases: a contribution from theory SS Rohman, B Sarmah, B Borthakur, GS Remya, CH Suresh, AK Phukan Organometallics 38 (14), 2770-2781, 2019 | 8 | 2019 |
Hydrogen elimination reactivity of ruthenium pincer hydride complexes: a DFT study GS Remya, CH Suresh New Journal of Chemistry 43 (36), 14634-14642, 2019 | 8 | 2019 |
Adsorption of Gases on Fullerene-like X12Y12 (X = Be, Mg, Ca, B, Al, Ga, C; Y = C, Si, N, P, O) Nanocages R Geetha Sadasivan Nair, AK Narayanan Nair, S Sun Energy & Fuels 37 (18), 14053-14063, 2023 | 6 | 2023 |
Substituent effect parameters: extending the applications to organometallic chemistry GS Remya, CH Suresh ChemPhysChem 21 (10), 1028-1035, 2020 | 5 | 2020 |
Intermolecular dihydrogen bonding in VI, VII, and VIII group octahedral metal hydride complexes with water KS Sandhya, GS Remya, CH Suresh Journal of Chemical Sciences 130, 1-8, 2018 | 4 | 2018 |
Adsorption of hazardous gases on Cyclo [18] carbon and its analogues RGS Nair, AKN Nair, S Sun Journal of Molecular Liquids 389, 122923, 2023 | 2 | 2023 |
On the ineffectiveness of grubbs-type iron olefin metathesis catalysts: Role of spin-state isomerism and cyclopropanation GS Remya, CH Suresh Inorganica Chimica Acta 538, 120971, 2022 | 1 | 2022 |
Adsorption of gases on B 12 N 12 and Al 12 N 12 nanocages RGS Nair, AKN Nair, S Sun New Journal of Chemistry 48 (18), 8093-8105, 2024 | | 2024 |
DFT studies on quantification of substitute effects and ligand modification to tune the reactivity of transition metal complexes GS Remya Chemical Sciences and Technology Division, National Institute for …, 2020 | | 2020 |