Assigning a kekulé structure to a conjugated molecule

DOI10.1016/0097-8485(94)00035-DzbMATH Open0821.92025OpenAlexW1999842208MaRDI QIDQ4834401FDOQ4834401

Authors: Pierre Hansen, Maolin Zheng 

Publication date: 30 May 1995

Published in: Computers & Chemistry (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1016/0097-8485(94)00035-d

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zbMATH Keywords

chemical graphKekulé structureconjugated moleculeEdmonds matching algorithm

Mathematics Subject Classification ID

Applications of graph theory (05C90) Edge subsets with special properties (factorization, matching, partitioning, covering and packing, etc.) (05C70) Molecular structure (graph-theoretic methods, methods of differential topology, etc.) (92E10)

Cited In (3)

• Graph theory for alternating hydrocarbons with attached ports
• Criteria for a structure to be mesoionic
• Applications of perfect matchings in chemistry

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