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On atom-bond connectivity molecule structure descriptors
- Source :
- Journal of the Serbian Chemical Society, Vol 81, Iss 3, Pp 271-276 (2016)
- Publication Year :
- 2016
- Publisher :
- Serbian Chemical Society, 2016.
-
Abstract
- The atom-bond connectivity index (ABC) is a degree-based molecular structure descriptor with well-documented chemical applications. In 2010 a distance-based new variant of this index (ABCGG) has been proposed. Until now, the relation between ABC and ABCGG has not been analyzed. In this paper, we establish the basic characteristics of this relation. In particular, ABC and ABCGG are not correlated and both cases ABC > ABCGG and ABC < ABCGG may occur in the case of (structurally similar) molecules. However, in the case of benzenoid hydrocarbons, ABC always exceeds ABCGG. [Projekat Ministarstva nauke Republike Srbije, br. 174033]
Details
- Language :
- English
- ISSN :
- 03525139 and 18207421
- Volume :
- 81
- Issue :
- 3
- Database :
- Directory of Open Access Journals
- Journal :
- Journal of the Serbian Chemical Society
- Publication Type :
- Academic Journal
- Accession number :
- edsdoj.6957b823adef4c1482df148e8e77437b
- Document Type :
- article
- Full Text :
- https://doi.org/10.2298/JSC150901093F