Reviews in Computational Chemistry, Volume 31

Autor:	Abby L. Parrill, Kenny B. Lipkowitz
EAN:	9781119518075
eBook Format:	PDF
Sprache:	Englisch
Produktart:	eBook
Veröffentlichungsdatum:	25.10.2018
Kategorie:	Technik / Wissen
Schlagworte:	<p>Guide to Reviews in Computational Chemistry; Text on reviews in computational chemistry; resource to review in computational chemistry; understanding computational chemistry; An introduction to Lattice-Boltzmann Modeling of Multicomponent Sy

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The Reviews in Computational Chemistry series brings together leading authorities in the field to teach the newcomer and update the expert on topics centered on molecular modeling, such as computer-assisted molecular design (CAMD), quantum chemistry, molecular mechanics and dynamics, and quantitative structure-activity relationships (QSAR). This volume, like those prior to it, features chapters by experts in various fields of computational chemistry. Topics in Volume 31 include:
Lattice-Boltzmann Modeling of Multicomponent Systems: An Introduction
Modeling Mechanochemistry from First Principles
Mapping Energy Transport Networks in Proteins
The Role of Computations in Catalysis
The Construction of Ab Initio Based Potential Energy Surfaces
Uncertainty Quantification for Molecular Dynamics

ABBY L. PARRILL, Ph.D., is a Professor in the Department of Chemistry at the University of Memphis, TN. Her research interests are in bioorganic chemistry, protein modeling, and rational ligand design and synthesis.

KENNY B. LIPKOWITZ, Ph.D., was one of the founding co-editors of Reviews in Computational Chemistry. He spent 28 years as an academician and then moved to the Office of Naval Research where he is a Program Manager in Computer-Aided Materials Design.