Nikolić, Sonja; Tolić, Iva Marija; Trinajstić, Nenad; Baučić, Ivo (2000) On the Zagreb indices as complexity indices. Croatica Chemica Acta, 73 (4). pp. 909921. ISSN 00111643
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Abstract
Two original Zagreb indices, denoted M(1) and M(2), and introduced in 1972, were symmetrymodified by summing up only degrees (SMM(1)) or edgeweights (SMM(2)) of symmetry nonequivalent vertices or edges of graphs. Their dependence on the structural features and symmetry of molecular graphs is studied. They were also compared to eight other complexity indices (RCI, TC, TC1, BT, BI, twc, wcx) on nine graphs (A, B, C, D, E, F, G, H, I) with five vertices that were earlier studied by several research groups. The TC, TC1 and Nt produce exactly the same complexity ordering of nine graphs (I > H > G > F > E > D > C > B > A). The ordering produced by M(1) is different from this ordering in that it cannot discriminate E and F, and C and D. Likewise, M(2) and twc produce exactly the same ordering and the latter ordering differs from the former only in the reverse order of E and F. Orderings produced by SMM(1) and SMM(2) differ considerably from orderings given by TC, TC1 and N(t) or M(2) and twc.
Item Type:  Article  

Additional Information:  Rad je prezentiran na skupu Thirteenth Dubrovnik International Course and Conference MATH/CHEM/COMP'98 and the First International Dubrovnik NMR Course DU'99 NMR.  
Uncontrolled Keywords:  complexity indices; molecular graphs; saturated hydrocarbons; Zagreb indices; molecularorbitals; graph theory; index  
Subjects:  NATURAL SCIENCES > Chemistry  
Divisions:  Division for Marine and Enviromental Research Division of Physical Chemistry 

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Depositing User:  Nenad Trinajstić  
Date Deposited:  10 Oct 2013 08:35  
URI:  http://fulir.irb.hr/id/eprint/758 
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