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Carcinogenicity of polycyclic hydrocarbons and their interaction with DNA

โœ Scribed by T. F. Slater; P. A. Riley

Publisher
John Wiley and Sons
Year
2009
Tongue
English
Weight
371 KB
Volume
14
Category
Article
ISSN
0020-7608

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## Abstract The distinct molecular regions of a set of 28 polycyclic aromatic hydrocarbons (PAHs) showing varying degrees of carcinogenic activity (CA) have been analyzed on the basis of their calculated molecular electrostatic potential (MESP) at B3LYP/6โ€31+G(d,p) level of theory. The MESP, being