Mathematical chemistry | Application-specific graphs

Chemical graph theory

Chemical graph theory is the topology branch of mathematical chemistry which applies graph theory to mathematical modelling of chemical phenomena.The pioneers of chemical graph theory are Alexandru Balaban, Ante Graovac, Iván Gutman, Haruo Hosoya, Milan Randić and Nenad Trinajstić (also Harry Wiener and others).In 1988, it was reported that several hundred researchers worked in this area, producing about 500 articles annually. A number of monographs have been written in the area, including the two-volume comprehensive text by Trinajstić, Chemical Graph Theory, that summarized the field up to mid-1980s. The adherents of the theory maintain that the properties of a chemical graph (i.e., a graph-theoretical representation of a molecule) give valuable insights into the chemical phenomena. Others contend that graphs play only a fringe role in chemical research. One variant of the theory is the representation of materials as infinite Euclidean graphs, particularly crystals by periodic graphs. (Wikipedia).

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Graph Theory: 02. Definition of a Graph

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From playlist Graph Theory part-1

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Graph Theory: 04. Families of Graphs

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From playlist Graph Theory part-1

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What is a Graph? | Graph Theory

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From playlist Graph Theory

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Graph Theory: 03. Examples of Graphs

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From playlist Graph Theory part-1

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The Definition of a Graph (Graph Theory)

The Definition of a Graph (Graph Theory) mathispower4u.com

From playlist Graph Theory (Discrete Math)

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Graph Theory: 05. Connected and Regular Graphs

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From playlist Graph Theory part-1

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Graph Theory FAQs: 01. More General Graph Definition

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From playlist Graph Theory FAQs

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From playlist Graph Theory

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Alexander Gorsky - Random Regular Graphs and Critical Phenomena in the Forest

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Aurora Clark (5/26/21): Multiscale Many-body Correlations and Structure in Chemistry Data

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John Baez - Categories: the Mathematics of Connection - IPAM at UCLA

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From playlist Workshop: Mathematics of Collective Intelligence - Feb. 15 - 19, 2022.

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A conversation between Jonathan Gorard and Stephen Wolfram at the Wolfram Summer School 2022

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From playlist Conversations with Special Guests

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Raffaella Mulas - Spectral theory of hypergraphs

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What are Connected Graphs? | Graph Theory

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Wolfram Physics Project: Working Session Tuesday, Mar. 8, 2022 [Chemistry] --- Part 1

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Ante Graovac | Graph theory | Topological index | Topology (chemistry) | Wiener index | Mathematical chemistry | Molecule mining