On Topological Indices of Certain Families of Nanostar Dendrimers

被引:38
|
作者
Husin, Mohamad Nazri [1 ]
Hasni, Roslan [1 ]
Arif, Nabeel Ezzulddin [2 ]
Imran, Muhammad [3 ]
机构
[1] Univ Malaysia Terengganu, Sch Informat & Appl Math, Kuala Terengganu 21030, Terengganu, Malaysia
[2] Tikrit Univ, Dept Math, Coll Comp Sci & Math, Tikrit 34001, Iraq
[3] Natl Univ Sci & Technol, Sch Nat Sci, Dept Math, Sect H-12, Islamabad 44000, Pakistan
关键词
atom-bond connectivity index; geometric arithmetic index; dendrimer; BOND CONNECTIVITY INDEX; CHROMATIC POLYNOMIALS; NANOCRYSTALLINE STARCH; NANOTUBES; COMPUTATION; OXIDATION; NETWORKS; ALCOHOLS; PI;
D O I
10.3390/molecules21070821
中图分类号
Q5 [生物化学]; Q7 [分子生物学];
学科分类号
071010 ; 081704 ;
摘要
A topological index of graph G is a numerical parameter related to G which characterizes its molecular topology and is usually graph invariant. In the field of quantitative structure-activity (QSAR)/quantitative structure-activity structure-property (QSPR) research, theoretical properties of the chemical compounds and their molecular topological indices such as the Randi connectivity index, atom-bond connectivity (ABC) index and geometric-arithmetic (GA) index are used to predict the bioactivity of different chemical compounds. A dendrimer is an artificially manufactured or synthesized molecule built up from the branched units called monomers. In this paper, the fourth version of ABC index and the fifth version of GA index of certain families of nanostar dendrimers are investigated. We derive the analytical closed formulas for these families of nanostar dendrimers. The obtained results can be of use in molecular data mining, particularly in researching the uniqueness of tested (hyper-branched) molecular graphs.
引用
收藏
页数:10
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