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Classical molecular electrostatics: Recognition of ligands in proteins and the vibrational stark effect

Authors :
Mankoo, Parminder K.
Keyes, Tom
Source :
Journal of Physical Chemistry B. Dec 14, 2006, Vol. 110 Issue 49, p25074, 6 p.
Publication Year :
2006

Abstract

A study shows that classical electrostatistics describes the quantitative description of, both the binding of the diatomic ligands XO (X= C. N, O) to the heme group in myoglobin and the dependence of their vibrational frequencies upon an external field by classical electrolysis. It is suggested that ligand binding occurs via an electrostatic bond, a generalization of the standard ionic bond to include induction, and that classical electrostatics can replace quantum mechanics for a considerable simplification of some complex problems.

Details

Language :
English
ISSN :
15206106
Volume :
110
Issue :
49
Database :
Gale General OneFile
Journal :
Journal of Physical Chemistry B
Publication Type :
Academic Journal
Accession number :
edsgcl.157022902