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Molecular Similarity II

✍ Scribed by Robert Ponec (auth.), Prof. Dr. Kali Das Sen (eds.)


Publisher
Springer-Verlag Berlin Heidelberg
Year
1995
Tongue
English
Leaves
147
Series
Topics in Current Chemistry 174
Edition
1
Category
Library

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✦ Synopsis


Contents: R. Ponec, Similarity Models in the Theory of Pericyclic Macromolecules.-
P.C. Mishra, A. Kumar, Mapping of Molecular Electric Potentials and Fields.-
G. Tasi, I. PΓ‘linkΓ³, Using Molecular ElectrostaticPotentialMaps for Similarity Studies.-
P.J. Artymiuk, A.R. Poirette, D.W. Rice, P. Willett, The Useof Graph Theoretical Methods for the Comparison of theStructures of Biological Macromolecules.-
Y. Takahashi, Identification of Structural Similarity ofOrganic Molecules.

✦ Table of Contents


Similarity models in the theory of pericyclic reactions....Pages 1-26
Mapping of molecular electric potentials and fields....Pages 27-43
Using molecular electrostatic potential maps for similarity studies....Pages 45-71
The use of graph theoretical methods for the comparison of the structures of biological macromolecules....Pages 73-103
Identification of structural similarity of organic molecules....Pages 105-133

✦ Subjects


Theoretical and Computational Chemistry


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