Items where Author is "Mohan, Neetha"

Article

Mohan, Neetha ; Suresh, Cherumuttathu H. (2014) Anion Receptors Based on Highly Fluorinated Aromatic Scaffolds The Journal of Physical Chemistry A, 118 (24). pp. 4315-4324. ISSN 1089-5639

Mohan, Neetha ; Suresh, Cherumuttathu H. (2014) Accurate binding energies of hydrogen, halogen, and dihydrogen bonded complexes and cation enhanced binding strengths International Journal of Quantum Chemistry, 114 (13). pp. 885-894. ISSN 00207608

Mohan, Neetha ; Suresh, Cherumuttathu H. (2014) A Molecular Electrostatic Potential Analysis of Hydrogen, Halogen, and Dihydrogen Bonds The Journal of Physical Chemistry A, 118 (9). pp. 1697-1705. ISSN 1089-5639

Kumar, Anmol ; Gadre, Shridhar R. ; Mohan, Neetha ; Suresh, Cherumuttathu H. (2014) Lone Pairs: An Electrostatic Viewpoint The Journal of Physical Chemistry A, 118 (2). pp. 526-532. ISSN 1089-5639

Mohan, Neetha ; Suresh, Cherumuttathu H. ; Kumar, Anmol ; Gadre, Shridhar R. (2013) Molecular electrostatics for probing lone pair–π interactions Physical Chemistry Chemical Physics, 15 (42). p. 18401. ISSN 1463-9076

Vijayalakshmi, Kunduchi P. ; Mohan, Neetha ; Ajitha, Manjaly J. ; Suresh, Cherumuttathu H. (2011) Mechanism of epoxide hydrolysis in microsolvated nucleotide bases adenine, guanine and cytosine: A DFT study Organic & Biomolecular Chemistry, 9 (14). pp. 5115-5122. ISSN 1477-0520

Suresh, Cherumuttathu H. ; Mohan, Neetha ; Vijayalakshmi, K. Periya ; George, Renjumon ; Mathew, Janice M. (2009) Typical aromatic noncovalent interactions in proteins: A theoretical study using phenylalanine Journal of Computational Chemistry, 30 (9). pp. 1392-1404. ISSN 01928651

Suresh, Cherumuttathu H. ; Vargheese, Aswathy Mary ; Vijayalakshmi, K. Periya ; Mohan, Neetha ; Koga, Nobuaki (2008) Role of structural water molecule in HIV protease-inhibitor complexes: A QM/MM study Journal of Computational Chemistry, 29 (11). pp. 1840-1849. ISSN 01928651