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Hypergraph models of hydrocarbon molecules and their applications in computer chemistry

A new form of representing the structures of saturated hydrocarbons as hypergraphs of special kind is suggested. A vertex of such hypergraph corresponds to a carbon atom in the molecule, and a hyperedge is defined as a set of vertices corresponding to some fixed carbon atom and all carbon atoms boun...

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Main Authors: M. I. Skvortsova, I. I. Fashutdinova, N. A. Mikhailova
格式: Artigo
語言:Russo
出版: MIREA - Russian Technological University 2014-10-01
叢編:Тонкие химические технологии
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在線閱讀:https://www.finechem-mirea.ru/jour/article/view/445
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