ENGLISH

Chemical Graph Theory: Reactivity and Kinetics [incomplete]

By Danail Bonchev

Book information

Publisher
Taylor & Francis
Year
1992
ISBN
0856265152, 9780856265150
LCC
QD39.3.G73 C49 1992
Language
english
Format
PDF
Filesize
30 MB (31210981 bytes)
Series
Mathematical Chemistry
Edition
1
Pages
226\226
Topic
Chemistry
Library
avaxhome.ws
Time added
2010-05-31 15:29:46

Description

This volume is concerned with applications of graph theory to the study of chemical kinetics and reaction mechanisms. Methods of handling kinetic data are explained with emphasis on the derivation of rate laws and related problems. Graph-based classification and coding of reaction mechanisms along with approaches for determining their complexity are described, providing researchers with a useful tool in their search for new reaction mechanisms. The operator set approach to the structural and dynamic interrelations between chemical species is presented as a methodology for discovering new selection and prohibition rules. Also discussed are the reaction lattice technique and its application to aromaticity and pericyclic reactions, and the DARC/PELCO method, a topological tool for QSAR searching.

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