Name: Modelling Molecular Structure and Reactivity in Biological Systems (en Inglés)
Price: 3115.06 MXN
Availability: InStock
Author: naidoo, kevin j.
ISBN: 9780854046683

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portada Modelling Molecular Structure and Reactivity in Biological Systems (en Inglés)

Formato

Libro Físico

Editorial

Royal Society Of Chemistry

Autor

naidoo, kevin j.

Año

2006

Idioma

Inglés

N° páginas

293

Encuadernación

Tapa Dura

ISBN

0854046682

ISBN13

9780854046683

N° edición

Categorías

Biotecnología

Modelling Molecular Structure and Reactivity in Biological Systems (en Inglés)

Naidoo, Kevin J. (Autor) · Royal Society Of Chemistry · Tapa Dura

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Reseña del libro "Modelling Molecular Structure and Reactivity in Biological Systems (en Inglés)"

Computational and theoretical tools for understanding biological processes at the molecular level is an exciting and innovative area of science. Using these methods to study the structure, dynamics and reactivity of biomacromolecules in solution, computational chemistry is becoming an essential tool, complementing the more traditional methods for structure and reactivity determination. Modelling Molecular Structure and Reactivity in Biological Systems covers three main areas in computational chemistry; structure (conformational and electronic), reactivity and design. Initial sections focus on the link between computational and spectroscopic methods in the investigation of electronic structure. The use of Free Energy calculations for the elucidation of reaction mechanisms in enzymatic systems is also discussed. Subsequent sections focus on drug design and the use of database methods to determine ADME (absorption, distribution, metabolism, excretion) properties. This book provides a complete reference on state of the art computational chemistry practised on biological systems. It is ideal for researchers in the field of computational chemistry interested in its application to biological systems.