نتایج جستجو برای: atom type based topological indices

تعداد نتایج: 4169823  

Journal: :journal of physical & theoretical chemistry 2015
h. aghaie m. monajjemi f. shafiei

the relationship between the randic , wiener, hosoya , balaban, schultz indices, harary numbers anddistance matrix to enthalpies of formation (airf), heat capacity, (cp) , enthalpies of combustion (ah °c ),enthalpy of vaporization (ah °vap) and normal boiling points (bpk)of c2 c10 normal alkanes isrepresented

Journal: :Journal of chemical information and computer sciences 2001
Ovidiu Ivanciuc Teodora Ivanciuc Douglas J. Klein William A. Seitz Alexandru T. Balaban

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...

Journal: :iranian journal of mathematical chemistry 2010
g. h. fath–tabar a. azad n. elahinezhad

topological indices are numerical parameters of a graph which characterize its topology. inthis paper the pi, szeged and zagreb group indices of the tetrameric 1,3–adamantane arecomputed.

M. GHORBANI M. SONGHORI

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.

Journal: :Symmetry 2017
Mobeen Munir Waqas Nazeer Shazia Rafique Abdul Rauf Nizami Shin Min Kang

The recent discovery of boron triangular nanotubes competes with carbon in many respects. The closed form of M-polynomial of nanotubes produces closed forms of many degree-based topological indices which are numerical parameters of the structure and, in combination, determine properties of the concerned nanotubes. In this report, we give M-polynomials of boron triangular nanotubes and recover m...

2012
Hongbo Hua Shenggui Zhang

For a nontrivial graph G, its first Zagreb coindex is defined as the sum of degree sum over all non-adjacent vertex pairs in G and the second Zagreb coindex is defined as the sum of degree product over all non-adjacent vertex pairs in G. Till now, established results concerning Zagreb coindices are mainly related to composite graphs and extremal values of some special graphs. The existing liter...

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