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Computer-Aided Drug Design

Name: Computer-Aided Drug Design
Brand: Springer Nature Singapore
SKU: 33085910
Price: 142.39 EUR
Availability: InStock
Author: Dev Bukhsh Singh
ISBN: 9789811568145

Dev Bukhsh Singh

Lingua

Inglese

Libro Rigido

Codice Libristo: 33085910

Casa editrice Springer Nature Singapore, ottobre 2020

This book provides up-to-date information on bioinformatics tools for the discovery and development... Descrizione completa

Codice Libristo: 33085910

349 b

142.39 €

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This book provides up-to-date information on bioinformatics tools for the discovery and development of new drug molecules. It discusses a range of computational applications, including three-dimensional modeling of protein structures, protein-ligand docking, and molecular dynamics simulation of protein-ligand complexes for identifying desirable drug candidates. It also explores computational approaches for identifying potential drug targets and for pharmacophore modeling. Moreover, it presents structure- and ligand-based drug design tools to optimize known drugs and guide the design of new molecules. The book also describes methods for identifying small-molecule binding pockets in proteins, and summarizes the databases used to explore the essential properties of drugs, drug-like small molecules and their targets. In addition, the book highlights various tools to predict the absorption, distribution, metabolism, excretion (ADME) and toxicity (T) of potential drug candidates. Lastly, it reviews in silico tools that can facilitate vaccine design and discusses their limitations.