This volume is concerned with applications of graph theory to the study of chemical kinetics and reaction mechanisms. Methods of handling kinetic data are explained with emphasis on the derivation of rate laws and related problems. Graph-based classification and coding of reaction mechanisms along with approaches for determining their complexity are described, providing researchers with a useful tool in their search for new reaction mechanisms. The operator set approach to the structural and dynamic interrelations between chemical species is presented as a methodology for discovering new selection and prohibition rules. Also discussed are the reaction lattice technique and its application to aromaticity and pericyclic reactions, and the DARC/PELCO method, a topological tool for QSAR searching.
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First Sentence:
Graph theory has been widely applied in recent years in studies on chemical kinetics. Read the first page Key Phrases - Statistically Improbable Phrases (SIPs): (learn more)
anterior environment, structural interpolation, kinetic graph, conjugation parameter, topochromatic vectors, additivity deviations, exploratory correlation, minimal compounds, equivalence sites, synchronous generation, maximal compounds, null vertex, conjugation capacity, reaction lattice, graph theory methods, cyclic characteristics, pendant vertices, base determinants, evolutionary networks, noncatalytic reactions, reaction domain, heterogeneous catalytic reactions, generation pathway, mathematical chemistry, key population Key Phrases - Capitalized Phrases (CAPs): (learn more)
New York, Drug Design, Academic Press, All-Union Conference, Catalytic Reaction Mechanisms, Springer Verlag, Pure Appl, Deutscher Verlag, Law of Mass Action, Verlag Chemie New!
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Front Cover | Table of Contents | First Pages | Index | Back Cover | Surprise Me!
Graph theory has been widely applied in recent years in studies on chemical kinetics. Read the first page Key Phrases - Statistically Improbable Phrases (SIPs): (learn more)
anterior environment, structural interpolation, kinetic graph, conjugation parameter, topochromatic vectors, additivity deviations, exploratory correlation, minimal compounds, equivalence sites, synchronous generation, maximal compounds, null vertex, conjugation capacity, reaction lattice, graph theory methods, cyclic characteristics, pendant vertices, base determinants, evolutionary networks, noncatalytic reactions, reaction domain, heterogeneous catalytic reactions, generation pathway, mathematical chemistry, key population Key Phrases - Capitalized Phrases (CAPs): (learn more)
New York, Drug Design, Academic Press, All-Union Conference, Catalytic Reaction Mechanisms, Springer Verlag, Pure Appl, Deutscher Verlag, Law of Mass Action, Verlag Chemie New!
Books on Related Topics | Concordance | Text Stats Browse Sample Pages:
Front Cover | Table of Contents | First Pages | Index | Back Cover | Surprise Me!
Citations (learn more)
This book cites 16
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8
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- on page 257
- Orthomodular Lattices (London Mathematical Society Monographs) by G. Kalmbach on page 153
- Information Theoretic Indices for Characterization of Chemical Structures (Chemometrics Research Studies Series) by Danail Bonchev on page 96
- Graph Theory and Topology in Chemistry (Studies in Physical and Theoretical Chemistry) by R. Bruce King on page 94
- Thermodynamic Network Analysis of Biological Systems (Universitext) by J Schnakenberg on page 198
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- Chemical Reaction Networks: A Graph-Theoretical Approach by Oleg N. Temkin on page 153, and page 160
- Chemical Group Theory: Introduction and Fundamentals (Mathematical Chemistry) by Danail Bonchev in Front Matter
- Chemical Graph Theory: Introduction and Fundamentals (Mathematical Chemistry, Vol 1) by D Bonchev in Front Matter
- Principles and Methods for Accelerated Catalyst Design and Testing (NATO Science Series II: Mathematics, Physics and Chemistry) by E.G. Derouane on page 68
- Principles and Methods for Accelerated Catalyst Design and Testing (NATO Science Series II: Mathematics, Physics and Chemistry) by E.G. Derouane on page 68
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