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Graph Theory Applications in Chemical Indices Computation

Graph Theory Applications in Chemical Indices Computation

von Bo Peng und Wei Gao
Softcover - 9783659920295
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Beschreibung

Chemical compounds and drugs are often modeled as graphs where each vertex represents an atom of molecule and covalent bounds between atoms are represented by edges between the corresponding vertices. This graph derived from a chemical compounds is often called its molecular graph and can be different structures. An indicator defined over this molecular graph has been shown to be strongly correlated to various chemical properties of the compounds. In this paper, we determine the several important indices of some common appeared molecular graphs in chemical engineering.

Details

Verlag LAP LAMBERT Academic Publishing
Ersterscheinung 11. Juli 2016
Maße 22 cm x 15 cm x 0.4 cm
Gewicht 102 Gramm
Format Softcover
ISBN-13 9783659920295
Seiten 56

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