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The Journal of Physical Chemistry. B|March 12, 2014
Oxidation and nitration of tyrosine by ozone and nitrogen dioxide: reaction mechanisms and biological and atmospheric implicationsL Sandhiya, P Kolandaivel, K SenthilkumarPhysical Chemistry Chemical Physics : PCCP|August 15, 2014
On the nature of non-covalent interactions in isomers of 2,5-dichloro-1,4-benzoquinone dimers - ground- and excited-state propertiesB Vijaya Pandiyan, P Deepa, P KolandaivelJournal of Molecular Modeling|December 31, 2016
How do halogen bonds (S-O⋯I, N-O⋯I and C-O⋯I) and halogen-halogen contacts (C-I⋯I-C, C-F⋯F-C) subsist in crystal structures? A quantum chemical insightB Vijaya Pandiyan, P Deepa, P KolandaivelBiochimica Et Biophysica Acta|December 7, 2005
Structure and potential energy surface studies on 3(10) helices of hen egg white lysozyme and Phaseolus vulgaris arcelin-1 proteinsP Kolandaivel, P Selvarengan, K V GunavathyPhysical Chemistry Chemical Physics : PCCP|October 2, 2015
Do resonance-assisted intramolecular halogen bonds exist without a charge transfer and a σ-hole?B Vijaya Pandiyan, P Deepa, P KolandaivelJournal of Biomolecular Structure & Dynamics|April 25, 2017
Role of 6-Mercaptopurine in the potential therapeutic targets DNA base pairs and G-quadruplex DNA: insights from quantum chemical and molecular dynamics simulationsR Radhika, R Shankar, S Vijayakumar, et al.Physical Chemistry Chemical Physics : PCCP|September 20, 2013
Effect of structural fluctuations on charge carrier mobility in thiophene, thiazole and thiazolothiazole based oligomersK Navamani, G Saranya, P Kolandaivel, et al.The Journal of Physical Chemistry. A|May 17, 2011
Structural and spectral properties of 4-bromo-1-naphthyl chalcones: a quantum chemical studyR Nithya, N Santhanamoorthi, P Kolandaivel, et al.Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy|June 29, 2014
Structure and NLO properties of halogen (F, Cl) substituted formic acid dimersP Umadevi, L Senthilkumar, M Gayathri, et al.Physical Chemistry Chemical Physics : PCCP|December 18, 2013
Halogen bonds in crystal TTF derivatives: an ab initio quantum mechanical studyP Deepa, B Vijaya Pandiyan, P Kolandaivel, et al.Pageof 4