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Elango Munusamy
Elango Munusamy
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Intermolecular reactivity through the generalized philicity concept
R Parthasarathi, J Padmanabhan, M Elango, V Subramanian, ...
CHEMICAL PHYSICS LETTERS 394 (4-6), 225-230, 2004
2202004
Temperature dependence of chemical and biophysical rate processes: Phenomenological approach to deviations from Arrhenius law
V Aquilanti, KC Mundim, M Elango, S Kleijn, T Kasai
Chemical Physics Letters 498 (1-3), 209-213, 2010
1572010
Multiphilic descriptor for chemical reactivity and selectivity
J Padmanabhan, R Parthasarathi, M Elango, V Subramanian, ...
JOURNAL OF PHYSICAL CHEMISTRY A, 2007
1552007
Variation of electrophilicity during molecular vibrations and internal rotations
R Parthasarathi, M Elango, V Subramanian, PK Chattaraj
THEORETICAL CHEMISTRY ACCOUNTS 113 (5), 257-266, 2005
1402005
Stability and reactivity of all-metal aromatic and antiaromatic systems in light of the principles of maximum hardness and minimum polarizability
PK Chattaraj, DR Roy, M Elango, V Subramanian
JOURNAL OF PHYSICAL CHEMISTRY A 109 (42), 9590-9597, 2005
1132005
Modulation of aldose reductase inhibition by halogen bond tuning
J Fanfrlík, M Kolář, M Kamlar, D Hurný, FX Ruiz, A Cousido-Siah, ...
ACS Chemical Biology 8 (11), 2484-2492, 2013
852013
pK(a) prediction using group philicity
R Parthasarathi, J Padmanabhan, M Elango, K Chitra, V Subramanian, ...
JOURNAL OF PHYSICAL CHEMISTRY A 110 (20), 6540-6544, 2006
692006
Time-resolved surface-enhanced coherent sensing of nanoscale molecular complexes
DV Voronine, AM Sinyukov, X Hua, K Wang, PK Jha, E Munusamy, ...
Scientific reports 2 (1), 1-5, 2012
652012
Synthesis of unsymmetrical substituted 1, 4-dihydropyridines through thermal and microwave assisted [4+ 2] cycloadditions of 1-azadienes and allenic esters
L Singh, MP Singh Ishar, M Elango, V Subramanian, V Gupta, P Kanwal
The Journal of Organic Chemistry 73 (6), 2224-2233, 2008
582008
Initial hardness response and hardness profiles in the study of Woodward-Hoffmann rules for electrocyclizations
F De Proft, PK Chattaraj, PW Ayers, M Torrent-Sucarrat, M Elango, ...
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2008
532008
Quantum Chemistry of C3H6O Molecules: Structure and Stability, Isomerization Pathways, and Chirality Changing Mechanisms
M Elango, GS Maciel, F Palazzetti, A Lombardi, V Aquilanti
The Journal of Physical Chemistry A 114 (36), 9864-9874, 2010
502010
Chemical reactivity descriptor based aromaticity indices applied to [Al4]2- and [Al4]4- systems
PK Chattaraj, DR Roy, M Elango, V Subramanian
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM 759 (1-3), 109-110, 2006
502006
Relationship between electrophilicity index, Hammett constant and nucleus-independent chemical shift
M Elango, R Parthasarathi, GK Narayanan, AM Sabeelullah, U Sarkar, ...
JOURNAL OF CHEMICAL SCIENCES 117 (1), 61-65, 2005
492005
Copper (II) terpyridine complexes: effect of substituent on DNA binding and nuclease activity
V Uma, M Elango, BU Nair
European journal of inorganic chemistry 2007 (22), 3484-3490, 2007
482007
Spherical and hyperspherical representation of potential energy surfaces for intermolecular interactions
F Palazzetti, E Munusamy, A Lombardi, G Grossi, V Aquilanti
International Journal of Quantum Chemistry 111 (2), 318-332, 2011
472011
Carbohydrate-Aromatic Interactions: The Role of Curvature on XH...pi Interactions
RM Kumar, M Elango, V Subramanian
JOURNAL OF PHYSICAL CHEMISTRY A, 2010
452010
On the Nature of the Stabilization of Benzene⋅⋅⋅ Dihalogen and Benzene⋅⋅⋅ Dinitrogen Complexes: CCSD (T)/CBS and DFT‐SAPT Calculations
E Munusamy, R Sedlak, P Hobza
ChemPhysChem 12 (17), 3253-3261, 2011
412011
Structure and Stability of Water Chains (H2O)(n), n=5-20
R Parthasarathi, M Elango, V Subramanian, N Sathyamurthy
JOURNAL OF PHYSICAL CHEMISTRY A, 2009
372009
Structure, energetics, and reactivity of boric acid nanotubes: A molecular tailoring approach
M Elango, V Subramanian, AP Rahalkar, SR Gadre, N Sathyamurthy
JOURNAL OF PHYSICAL CHEMISTRY A, 2008
372008
Formaldehyde decomposition through profiles of global reactivity indices
M Elango, R Parthasarathi, V Subramanian, U Sarkar, PK Chattaraj
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM 723 (1-3), 43-52, 2005
362005
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