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Molecular graph

In chemical graph theory and in mathematical chemistry, a molecular graph or chemical graph is a representation of the structural formula of a chemical compound in terms of graph theory. A chemical graph is a labeled graph whose vertices correspond to the atoms of the compound and edges correspond to chemical bonds. Its vertices are labeled with the…

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Molecular graph

Nodes21
Edges20
Triples14
Avg. degree1.9
Density0.095238
Components1

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Molecular graph

Top relations

related to history · 13
Molecular graph → Arthur Cayley, Cayley, Chemical Graph Theory, Danail Bonchev, For, He, If, In, Isaac Newton's, Scottish, These, William Cullen, William Higgins
is a · 1
Molecular graph → molecular graph with hydrogen vertices deleted.In some important cases

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Important terminology

graph chemical atoms molecular vertices bonds compound edges diagrams particular connected represent graphs structural formula labeled correspond early forces century

Entity relationships Subject–Predicate–Object triples

SubjectPredicateObjectConfidenceSrc
Molecular graphis amolecular graph with hydrogen vertices deleted.In some important cases0.90text
Molecular graphrelated to historyArthur Cayley0.60section
Molecular graphrelated to historyFor0.60section
Molecular graphrelated to historyCayley0.60section
Molecular graphrelated to historyHe0.60section
Molecular graphrelated to historyIf0.60section
Molecular graphrelated to historyDanail Bonchev0.60section
Molecular graphrelated to historyChemical Graph Theory0.60section
Molecular graphrelated to historyIn0.60section
Molecular graphrelated to historyIsaac Newton's0.60section
Molecular graphrelated to historyScottish0.60section
Molecular graphrelated to historyWilliam Cullen0.60section

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    Min side: 3
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