Total and Local Quadratic Indices of the Molecular Pseudograph's Atom Adjacency Matrix: Applications to the Prediction of Physical Properties of Organic Compounds
A novel topological approach for obtaining a family of new molecular descriptors is proposed. In this connection, a vector space E (molecular vector space), whose elements are organic molecules, is defined as a “direct sum“ of different ℜi spaces. In this way we can represent molecule...
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| Hlavní autor: | |
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| Médium: | Artigo |
| Jazyk: | Inglês |
| Vydáno: |
MDPI AG
2003-08-01
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| Edice: | Molecules |
| Témata: | |
| On-line přístup: | http://www.mdpi.com/1420-3049/8/9/687/ |
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