In the research of QSAR and QSPR correlations, topological indices such as Randi’c index, Zagreb ABC geometric-arithmetic index have been proposed to analyze bio-compatibility chemical compounds. Chemical graph theory is combination Chemistry Graph theory, this deals with topology mathematical study isomerism development which has applications in QSPR. article, we consider Octahedron networks f...

The Wiener index of a graph G is defined as W(G) = 1/2∑{x,y}⊆V(G)d(x,y), where V(G) is the set of all vertices of G and for x,y ∈ V(G), d(x,y) denotes the length of a minimal path between x and y. In this paper, we first report our recent results on computing Wiener, PI and Balaban indices of some nanotubes and nanotori. Next, the PI and Szeged indices of a new type of nanostar dendrimers are c...

let g be a connected simple (molecular) graph. the distance d(u, v) between two vertices u and v of g is equal to the length of a shortest path that connects u and v. in this paper we compute some distance based topological indices of h-phenylenic nanotorus. at first we obtain an exactformula for the wiener index. as application we calculate the schultz index and modified schultz index of this ...

Let G be a simple graph with the vertex set V(G) and edge set E(G) respectively. The degree of a vertex v in G is the number of vertices in G which are connected to v by an edge and denoted by dG(v). A topological index is a graph invarient which is numerical parameter obtained from a graph which characterize its topology.Thus for two isomorphic graphG and H the value of a particular topologica...

Solutions of physical equations which have non-trivial topological properties have been studied for already more than five years. As examples we may give the "monopole""2 and the ' ' in~tanton'~ in gauge field theories and the "pseudoparticle" in a two-dimensional isotropic f e r r ~ m a g n e t . ~ All these solutions a re characterized by some topological index: the magnetic charge of the mon...

the degree of aromaticity of mono-substituted derivatives of benzene has beeninvestigated using a new index based on electric field gradient index, by using two mechanicalquantum methods with gaussian 03. two different basis sets have applied to study and theresults compared. this strategy has demonstrated that, due to violation of symmetry in have pisystems,how the degree of aromaticity can ha...

The atom-bond connectivity index is a recently introduced topological index defined as [Formula: see text], where du denotes degree of vertex u. Here we define a new version of the ABC index as [Formula: see text], where nu denotes the number of vertices of G whose distances to vertex u are smaller than those to other vertex v of the edge e = uv, and nv is defined analogously. The goal of this ...

The atom-bond connectivity (ABC) index is a recently introduced topological index, defined as ABC(G) = ∑ uv∈E(G) √ du+dv−2 dudv , where du (or dv) is the degree the vertex u (or v). The ABC index of benzenoid systems and phenylenes are computed, a simple relation is established between the atom-bond connectivity index of a phenylene and the corresponding hexagonal squeeze in this paper. Mathema...