Chemical Graph Theory

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A01=D Bonchev
Adjacency Matrix
advanced chemical structure analysis
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Author_D Bonchev
Bipartite Graph
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Characteristic Polynomial
Chemical Graph Theory
Chemical Graphs
combinatorial enumeration
Constitutional Isomers
Crum Brown
Dualist Graph
eigenvalue analysis
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Graph Invariants
Graph Spectral Theory
Graphic Polynomials
Holds
Huckel Theory
mathematical chemistry
Molecular Graph
molecular topology
Odd
Permutation Groups
quantum chemical models
Skeleton Graph
Structural Isomers
symmetry in molecules
Terminal Vertices
Topological Index
Valence Isomers
Vertex Pair
Vertex Set
Vice Versa

Product details

  • ISBN 9780367450700
  • Weight: 2800g
  • Dimensions: 152 x 229mm
  • Publication Date: 18 Dec 2020
  • Publisher: Taylor & Francis Ltd
  • Publication City/Country: GB
  • Product Form: Paperback
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This volume presents the fundamentals of graph theory and then goes on to discuss specific chemical applications. Chapter 1 provides a historical setting for the current upsurge of interest in chemical graph theory. Chapter 2 gives a full background of the basic ideas and mathematical formalism of graph theory and includes such chemically relevant notions as connectedness, graph matrix representations, metric properties, symmetry and operations on graphs. This is followed by a discussion on chemical nomenclature and the trends in its rationalization by using graph theory, which has important implications for the storage and retrieval of chemical information. This volume also contains a detailed discussion of the relevance of graph-theoretical polynomials; it describes methodologies for the enumeration of isomers, incorporating the classical Polya method, as well as more recent approaches.
Bonchev, D

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