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Computational Methods for GPCR Drug Discovery

Computational Methods for GPCR Drug Discovery

Brand
Springer Nature
Manufacturer
N/A
Part Number
0
GTIN
9781493974658
Condition
New
Product Description

This volume looks at modern computational strategies and techniques used in GPCR drug discovery including structure and ligand-based approaches and cheminformatics. The chapters in this book describe how these approaches can be applied to address key drug discovery issues, such as receptor structure modelling, function and dynamics, prediction of protein-water-ligand interactions and binding kinetics, free energy of binding, interconversion between agonists and antagonists, deorphanization of GPCRs, and the discovery of biased and allosteric modulators. Written in the highly successfulMethods in Molecular Biologyseries format, chapters include introductions to their respective topics, lists of the necessary software and tools, step-by-step, readily reproducible modelling protocols, and tips on troubleshooting and avoiding known pitfalls. Cutting-edge and unique,Computational Methods for GPCR Drug Discoveryis a valuable resource for structural and molecular biologists, computational and medicinal chemists, pharmacologists, and drug designers.

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