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Issue Date
Title
Author(s)
2014
Lone Pairs: An Electrostatic viewpoint
Anmol Kumar
;
Gadre, S R
;
Neetha Mohan
;
Suresh, C H
2014
A molecular electrostatic potential analysis of hydrogen, halogen, and dihydrogen bonds
Neetha Mohan
;
Suresh, C H
2014
Cooperativity and cluster growth patterns in acetonitrile: A DFT study
Remya, K
;
Suresh, C H
2014
Nickel(II) complexes of pentadentate N5 ligands as catalysts for alkane hydroxylation by using m-CPBA as oxidant: a combined experimental and computational study
Sankaralingam, M
;
Balamurugan, M
;
Palaniandavar, M
;
Vadivelu, P
;
Suresh, C H
2014
Designing metal hydride complexes for water splitting reactions: A molecular electrostatic potential approach
Sandhya, K S
;
Suresh, C H
2014
Molecular electrostatics for probing hydrogen bonds, halogen bonds and lone pair-π interactions and design of receptors for lone pair bearing molecules
Neetha Mohan
;
Suresh, C H
2014
Accurate binding energies of hydrogen, halogen, and dihydrogen bonded complexes and cation enhanced binding strengths
Neetha Mohan
;
Suresh, C H
2014
Anion receptors based on highly fluorinated aromatic scaffolds
Neetha Mohan
;
Suresh, C H
2014-10-18
Fused core-modified planar antiaromatic 32 pi heptaphyrins: Unusual synthesis and structural diversity
Karthik, G
;
Srinivasan, A
;
Suresh, C H
;
Chandrashekar, T K
2014-10-24
Cysteine-based fluorescence “turn-on” sensors for Cu 2+ and Ag +
Haridas, V
;
Praveen Kumar, P
;
Suresh, C H
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Author
5
Neetha Mohan
1
Anmol Kumar
1
Balamurugan, M
1
Chandrashekar, T K
1
Gadre, S R
1
Haridas, V
1
Karthik, G
1
Palaniandavar, M
1
Praveen Kumar, P
1
Remya, K
.
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Subject
2
Hydrogen bonds
2
Molecular electrostatic potential
1
Ab initio methods
1
Acetonitrile
1
Anion receptors
1
Atoms in molecules (AIM)
1
Brueckner doubles method
1
Cluster formation
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Computational chemistry
1
Density functional calculations
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