Topological indices are the numerical value associated with chemical constitution purporting for correlation of chemical structure with various physical properties, chemical reactivity or biological activity. Graph theory is a delightful playground for the exploration of proof techniques in Discrete Mathematics and its results have applications in many areas of sciences. One of the useful indic...

we give sharp upper bounds on the zagreb indices and lower bounds on the zagreb coindices of chemical trees and characterize the case of equality for each of these topological invariants.

The fact that the properties of a molecule are tightly connected to its structural  characteristics  is one of the fundamental concepts in chemistry. In this connection,  graph theory has been successfully applied in developing some relationships between topological indices and some thermodynamic properties. So ,  a novel method for computing the new descriptors to construct a quantitative rela...

let $g$ be a graph and let $m_{ij}(g)$, $i,jge 1$, be the number of edges $uv$ of $g$ such that ${d_v(g), d_u(g)} = {i,j}$. the {em $m$-polynomial} of $g$ is introduced with $displaystyle{m(g;x,y) = sum_{ile j} m_{ij}(g)x^iy^j}$. it is shown that degree-based topological indices can be routinely computed from the polynomial, thus reducing the problem of their determination in each particular ca...

Wiener index is a topological index based on distance between every pair of vertices in a graph G. It was introduced in 1947 by one of the pioneer of this area e.g, Harold Wiener. In the present paper, by using a new method introduced by klavžar we compute the Wiener and Szeged indices of some nanostar dendrimers.

Abstract. Topological indices are the numerical value associated with chemical constitution purporting for correlation of chemical structure with various physical properties, chemical reactivity or biological activity. Graph theory is a delightful playground for the exploration of proof techniques in Discrete Mathematics and its results have applications in many areas of sciences. A graph is a ...

zagreb indices belong to better known and better researched topological indices. weinvestigate here their ability to discriminate among benzenoid graphs and arrive at some quiteunexpected conclusions. along the way we establish tight (and sometimes sharp) lower andupper bounds on various classes of benzenoids.

We show that the special case of Serre duality involved in the Borel-Bott-Weil theorem can be formulated and proved in the context of equi-variant Kasparov theory by combining the Atiyah-Singer index theorem and the framework of equivariant correspondences developed in another paper by the first author and Ralf Meyer. The twisted Dolbeault cohomology groups of a flag variety that figure in the ...

Chemical structures of organic compounds are characterized numerically by a variety of structural descriptors, one of the earliest and most widely used being the Wiener index W, derived from the interatomic distances in a molecular graph. Extensive use of such structural descriptors or topological indices has been made in drug design, screening of chemical databases, and similarity and diversit...

It is well known that the chemical behavior of a compound is dependent upon the structure of itsmolecules. Quantitative structure – activity relationship (QSAR) studies and quantitative structure –property relationship (QSPR) studies are active areas of chemical research that focus on the nature ofthis dependency. Topological indices are the numerical value associated with chemical constitution...