Several different topological indices (the carbon number, the Wiener index, the Balaban dis­ tance sum connectivity index, the Randic molecular identification number, and the Randic molecular connectivity indices °/, 2%, 3̂ p and 3/ c) were employed in the correlation of the velocity of ultrasonic sound in a variety of alkane and alcohol species. Using linear regression analyses and published so...

Let GG be a graph. The energy of is defined as the summation absolute values eigenvalues adjacency matrix GG. It possible to study several types graph originating from defining various matrices by correspondingly different invariants. first step computing characteristic polynomial for obtaining corresponding In this paper, formulae coefficients polynomials both Randic and Sombor path PnPn , cyc...

In this paper, we present some new lower and upper bounds for the modified Randic index in terms of maximum, minimum degree, girth, algebraic connectivity, diameter and average distance. Also we obtained relations between this index with Harmonic and Atom-bond connectivity indices. Finally, as an application we computed this index for some classes of nano-structures and linear chains.

qspr study on benzene derivatives have been made using recently introduced topological methodology. in this study the relationship between the randic' (x'), balaban (j), szeged (sz),harary (h), wiener (w), hyperwiener and wiener polarity (wp) to the thermal energy (eth), heat capacity (cv) and entropy (s) of benzene derivatives is represented.physicochemical properties are taken from the quantu...

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 introduce a partial order on the collection of chemical trees based on tree transformations. This partial order is tightly related to the Randić connectivity index χ. Its analysis provides new structural information about the behavior of χ. As an illustration of the approach presented, we give a different and more structural view of some known results about the first values of χ on the colle...

We discuss some features of the orthogonalization methods commonly applied to QSPR QSAR studies. We outline the well known multivariable linear regression analysis in vector form in order to compare mainly Randic and Gram-Schmidt orthogonalization procedures and also cast the basis for other approaches like Löwdin’s one. We expect that present review may become the starting point for future dev...

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 ...

Let G be a collection of graphs with n vertices. We present a simple description of [G]χ = {H ∈ G : χ(H) = χ(G)} where χ denotes the Randić index. We associate to G a Q-linear map ρ : Qm → Qk (for some integers k, m depending on G) such that the kernel of ρ contains the necessary information to describe [G]χ in terms of linear equations. These results provide precise tools for analyzing the beh...

QSPR study on benzene derivatives have been made using recently introduced topological methodology. In this study the relationship between the Randic' (x'), Balaban (J), Szeged (Sz),Harary (H), Wiener (W), HyperWiener and Wiener Polarity (WP) to the thermal energy (Eth), heat capacity (CV) and entropy (S) of benzene derivatives is represented. Physicochemical properties are taken from the quant...