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Reviews Computational V31 C

by Abby L. Parrill, Kenny B. Lipkowitz

Wiley

Hardcover 352 pages English Nov 06, 2018

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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 IntroductionModeling Mechanochemistry from First PrinciplesMapping Energy Transport Networks in ProteinsThe Role of Computations in CatalysisThe Construction of Ab Initio Based Potential Energy SurfacesUncertainty Quantification for Molecular Dynamics
Author:
Abby L. Parrill, Kenny B. Lipkowitz
Publisher:
Wiley
Publication Date:
Nov 06, 2018
Number of pages:
352 pages
Language:
English
Binding:
Hardcover
ISBN-10:
1119518024
ISBN-13:
9781119518020