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Discrete Mathematics Applied to QSAR and Beyond,9781439806623
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Discrete Mathematics Applied to QSAR and Beyond

by ;
Edition:
1st
ISBN13:

9781439806623

ISBN10:
1439806624
Format:
Hardcover
Pub. Date:
8/1/2016
Publisher(s):
CRC Press

Questions About This Book?

What version or edition is this?
This is the 1st edition with a publication date of 8/1/2016.
What is included with this book?
  • The New copy of this book will include any supplemental materials advertised. Please check the title of the book to determine if it should include any CDs, lab manuals, study guides, etc.

Summary

Theoretical chemistry has been dominated by quantum chemistry to such an extent that the potential of discrete mathematics has focused on combinatorial and topological properties of discrete objects. This book summarizes results related to chemical structures that go beyond molecular stability and energetics, addressing such topics as molecular similarity, QSAR, QSPR characterization of DNA and proteins, as well as DNA and protein alignment. Broad in scope, including bioinformatics topics and proteomics maps, it presents an outline of molecular descriptors that considers aromaticity of benzenoid and non-benzenoid compounds, properties of conjugated polymers, and stabilities of fullerenes.


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