Description of the Electronic Structure of Organic...

Description of the Electronic Structure of Organic Chemicals Using Semiempirical and Ab Initio Methods for Development of Toxicological QSARs

Netzeva, Tatiana I., Aptula, Aynur O., Benfenati, Emilio, Cronin, Mark T. D., Gini, Giuseppina, Lessigiarska, Iglika, Maran, Uko, Vračko, Marjan, Schüürmann, Gerrit
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Volume:
45
Language:
english
Journal:
Journal of Chemical Information and Modeling
DOI:
10.1021/ci049747p
Date:
January, 2005
File:
PDF, 207 KB
english, 2005
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