Molecular Quantum Similarity in QSAR and Drug Design

Molecular Quantum Similarity in QSAR and Drug Design
Author :
Publisher : Springer Science & Business Media
Total Pages : 138
Release :
ISBN-10 : 9783642572739
ISBN-13 : 3642572731
Rating : 4/5 (731 Downloads)

Book Synopsis Molecular Quantum Similarity in QSAR and Drug Design by : R. Carbo-Dorca

Download or read book Molecular Quantum Similarity in QSAR and Drug Design written by R. Carbo-Dorca and published by Springer Science & Business Media. This book was released on 2012-12-06 with total page 138 pages. Available in PDF, EPUB and Kindle. Book excerpt: The authors introduce the concept of Molecular Quantum Similarity, developed in their laboratory, in a didactic form. The basis of the concept combines quantum theoretical calculations with molecular structure and properties even for large molecules. They give definitions and procedures to compute similarities molecules and provide graphical tools for visualization of sets of molecules as n-dimensional point charts.


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