Libro molecular quantum similarity in qsar and drug design De besalu,girones,amat,robert,carbo-dorca

portada molecular quantum similarity in qsar and drug design

Formato

Libro Físico

Editorial

springer publishing map

Autor

besalu,girones,amat,robert,carbo-dorca

Idioma

Inglés

N° páginas

123

ISBN

3540675817

ISBN13

9783540675815

Categorías

Matemáticas aplicadas

molecular quantum similarity in qsar and drug design

Besalu,Girones,Amat,Robert,Carbo-Dorca (Autor) · springer publishing map · Libro Físico

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Reseña del libro "molecular quantum similarity in qsar and drug design"

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.