Atomic Reaction Mapping

Name: Atomic Reaction Mapping
Brand: VDM Verlag Dr. Mueller E.K.
SKU: 9783639073584
Price: 273.57 RON
Availability: InStock

Algorithms for Evaluating Detailed ChemicalKinetic Mechanisms

Autor: John Crabtree

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Legare: Carte broșată

Editura: VDM Verlag Dr. Mueller E.K.

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273.57 lei

Modeling chemical reactions and mechanisms can be ofgreat benefit to the chemical process industry....

Informații despre carte

Autor

John Crabtree

Limbă

engleză

Legare

Carte - Carte broșată

Publicat

2008

Pagini

EAN

9783639073584

ISBN

3639073584

Enbook ID

06816626

Editura

VDM Verlag Dr. Mueller E.K.

Greutate

136

Dimensiuni

152 x 229 x 5

Descriere completă

Modeling chemical reactions and mechanisms can be ofgreat benefit to the chemical process industry. Atypical chemical mechanism is a database composed ofthousands of reactions involving a hundred or morespecies. A fundamental prerequisite of mechanismanalysis and classification is the ability to mapatomic reactions. Reaction mapping is alsofundamental in the analysis of biologicalpathways, enzymatic reaction data, tracerexperiments, and the consistencychecking of pathway databases. Biological moleculesoften have complex structures that can be nearlyimpossible to validate manually. Until now, reactionmapping approaches have relied on solutions based onattempts to partially solve NP-Complete problems orlimiting the type of reaction processed. This bookpresents algorithms that are uniquely capable ofmapping any reaction that can be represented as a setof chemical graphs, efficiently and optimally.MechA, a system built for mechanism analysis using anexpert system as well as these algorithms is alsodescribed. This book should beof interest to thosewith a background in cheminformatics, bioinformatics,algorithms, expert systems, or chemical engineering.

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Atomic Reaction Mapping

Algorithms for Evaluating Detailed ChemicalKinetic Mechanisms

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Descriere completă

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