Bader’s theory of atoms in molecules (AIM) and its applications to chemical bonding PSV Kumar, V Raghavendra, V Subramanian Journal of Chemical Sciences 128, 1527-1536, 2016 | 545 | 2016 |
Electrophilicity-based charge transfer descriptor J Padmanabhan, R Parthasarathi, V Subramanian, PK Chattaraj The Journal of Physical Chemistry A 111 (7), 1358-1361, 2007 | 535 | 2007 |
Electrophilicity index as a possible descriptor of biological activity R Parthasarathi, V Subramanian, DR Roy, PK Chattaraj Bioorganic & medicinal chemistry 12 (21), 5533-5543, 2004 | 458 | 2004 |
Hydrogen bonding without borders: an atoms-in-molecules perspective R Parthasarathi, V Subramanian, N Sathyamurthy The Journal of Physical Chemistry A 110 (10), 3349-3351, 2006 | 440 | 2006 |
Application of quantum chemical descriptor in quantitative structure activity and structure property relationship P Thanikaivelan, V Subramanian, JR Rao, BU Nair Chemical Physics Letters 323 (1-2), 59-70, 2000 | 341 | 2000 |
Intermolecular reactivity through the generalized philicity concept R Parthasarathi, J Padmanabhan, M Elango, V Subramanian, ... Chemical physics letters 394 (4-6), 225-230, 2004 | 290 | 2004 |
Interaction of DNA with [Cr (Schiff base)(H2O) 2] ClO4 R Vijayalakshmi, M Kanthimathi, V Subramanian, BU Nair Biochimica et Biophysica Acta (BBA)-General Subjects 1475 (2), 157-162, 2000 | 268 | 2000 |
Toxicity analysis of benzidine through chemical reactivity and selectivity profiles: a DFT approach R Parthasarathi, J Padmanabhan, U Sarkar, B Maiti, V Subramanian, ... Internet Electronic Journal of Molecular Design 2 (12), 798-813, 2003 | 242 | 2003 |
Electrophilicity as a possible descriptor for toxicity prediction DR Roy, R Parthasarathi, B Maiti, V Subramanian, PK Chattaraj Bioorganic & medicinal chemistry 13 (10), 3405-3412, 2005 | 235 | 2005 |
Stabilization of collagen using plant polyphenol: role of catechin B Madhan, V Subramanian, JR Rao, BU Nair, T Ramasami International journal of biological macromolecules 37 (1-2), 47-53, 2005 | 231 | 2005 |
Chemical reactivity profiles of two selected polychlorinated biphenyls R Parthasarathi, J Padmanabhan, V Subramanian, B Maiti, PK Chattaraj The Journal of Physical Chemistry A 107 (48), 10346-10352, 2003 | 201 | 2003 |
Comparison of global reactivity descriptors calculated using various density functionals: a QSAR perspective R Vijayaraj, V Subramanian, PK Chattaraj Journal of chemical theory and computation 5 (10), 2744-2753, 2009 | 195 | 2009 |
Multiphilic descriptor for chemical reactivity and selectivity J Padmanabhan, R Parthasarathi, M Elango, V Subramanian, ... The Journal of Physical Chemistry A 111 (37), 9130-9138, 2007 | 190 | 2007 |
Hydrogen bonding in phenol, water, and phenol− water clusters R Parthasarathi, V Subramanian, N Sathyamurthy The Journal of Physical Chemistry A 109 (5), 843-850, 2005 | 189 | 2005 |
Achieving highly efficient CO 2 to CO electroreduction exceeding 300 mA cm− 2 with single-atom nickel electrocatalysts HY Jeong, M Balamurugan, VSK Choutipalli, E Jeong, V Subramanian, ... Journal of Materials Chemistry A 7 (17), 10651-10661, 2019 | 186 | 2019 |
DNA cleavage by a chromium (III) complex R Vijayalakshmi, M Kanthimathi, V Subramanian, BU Nair Biochemical and biophysical research communications 271 (3), 731-734, 2000 | 182 | 2000 |
Toxicity analysis of 33′ 44′ 5-pentachloro biphenyl through chemical reactivity and selectivity profiles R Parthasarathi, J Padmanabhan, V Subramanian, B Maiti, PK Chattaraj Current Science, 535-542, 2004 | 179 | 2004 |
Understanding the role of water during ionic liquid pretreatment of lignocellulose: co-solvent or anti-solvent? J Shi, K Balamurugan, R Parthasarathi, N Sathitsuksanoh, S Zhang, ... Green Chemistry 16 (8), 3830-3840, 2014 | 178 | 2014 |
Molecular dynamics simulations to investigate polymer–polymer and polymer–metal oxide interactions B Prathab, V Subramanian, TM Aminabhavi Polymer 48 (1), 409-416, 2007 | 170 | 2007 |
Is the fukui function a right descriptor of hard− hard interactions? J Melin, F Aparicio, V Subramanian, M Galván, PK Chattaraj The Journal of Physical Chemistry A 108 (13), 2487-2491, 2004 | 168 | 2004 |