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Pregled bibliografske jedinice broj: 609675

Časopis

Autori: Došlić, Tomislav; Reti, Tamas
Naslov: Novel Degree-based Molecular Descriptors with Increased Discriminating Power
( Novel Degree-based Molecular Descriptors with Increased Discriminating Power )
Izvornik: Acta Polytechnica Hungarica (1785-8860) 9 (2012), 4; 17-30
Vrsta rada: članak
Ključne riječi: Zagreb indices; pseudo-regular graphs; QSAR/QSPR studies
( Zagreb indices; pseudo-regular graphs; QSAR/QSPR studies )
Sažetak:
In the present study we investigate some general problems concerning the degeneracy of widely used topological indices (graph invariants), and we propose a novel family of molecular desriptors characterized by a decreased degeneracy level. A special feature of topological indices of novel type is that they take into account the degrees of vertices on increasing distances from a single vertex. According to the comparative tests performed on samples of isospectral graphs and of graphs of small diameter, the new descriptors are judged to be more efficient for discriminating between topological structures of molecular graphs than several traditional molecular indices.
Projekt / tema: 037-0000000-2779, 177-0000000-0884
Izvorni jezik: eng
Rad je indeksiran u
bazama podataka:
Scopus
SCI-EXP, SSCI i/ili A&HCI
Science Citation Index Expanded (SCI-EXP) (sastavni dio Web of Science Core Collectiona)
Kategorija: Znanstveni
Znanstvena područja:
Matematika
URL cjelovitog teksta:
Časopis izlazi u samo elektroničkom izdanju: NE
Google Scholar: Novel Degree-based Molecular Descriptors with Increased Discriminating Power
Upisao u CROSBI: doslic@grad.hr (doslic@grad.hr), 2. Sij. 2013. u 15:42 sati



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