A survey on graphs extremal with respect to distance-based topological indices

K Xu, M Liu, I Gutman, B Furtula - MATCH Communications in …, 2014 - scidar.kg.ac.rs
A Survey on Graphs Extremal with Respect to Distance–Based Topological Indices Page 1 A
Survey on Graphs Extremal with Respect to Distance–Based Topological Indices Kexiang Xua …

[PDF][PDF] The first Zagreb index 30 years after

I Gutman, KC Das - MATCH Commun. Math. Comput. Chem, 2004 - match.pmf.kg.ac.rs
The graph invariant M., known under the name first Zagreb inder, equal to the sum of the
squares of the degrees of the vertices of the respective (molecular) graph, was first …

Wiener index of hexagonal systems

AA Dobrynin, I Gutman, S Klavžar, P Žigert - Acta Applicandae …, 2002 - Springer
The Wiener index W is the sum of distances between all pairs of vertices of a (connected)
graph. Hexagonal systems (HS's) are a special type of plane graphs in which all faces are …

Predicting skin permeability from complex vehicles

D Karadzovska, JD Brooks, NA Monteiro-Riviere… - Advanced drug delivery …, 2013 - Elsevier
It is now widely accepted that vehicle and formulation components influence the rate and
extent of passive chemical absorption through skin. Significant progress, over the last …

[BOOK][B] Discrete calculus: Applied analysis on graphs for computational science

LJ Grady, JR Polimeni - 2010 - Springer
The field of discrete calculus, also known as" discrete exterior calculus", focuses on finding a
proper set of definitions and differential operators that make it possible to operate the …

On topological indices, boiling points, and cycloalkanes

G Rücker, C Rücker - Journal of chemical information and …, 1999 - ACS Publications
The experimental boiling points (bp) of saturated hydrocarbons (acyclic through polycyclic)
up to decanes are systematically compiled. The bp values are classified into groups of lower …

[BOOK][B] Graph-theoretical matrices in chemistry

D Janezic, A Milicevic, S Nikolic, N Trinajstic - 2015 - books.google.com
Divided into five sections, this book offers 200 graph-theoretical matrices covering
adjacency and related matrices, distance and related matrices, incidence matrices, and …

Resistance distance in regular graphs

I Lukovits, S Nikolić, N Trinajstić - International Journal of …, 1999 - Wiley Online Library
This report considers the resistance distance as a recently proposed new intrinsic metric on
(molecular) graphs, and in particular, the sum R over resistance distances between all pairs …

QSAR comparative study of Wiener descriptors for weighted molecular graphs

O Ivanciuc - Journal of chemical information and computer …, 2000 - ACS Publications
Quantitative structure− property relationship (QSPR) and quantitative structure− activity
relationship (QSAR) studies use statistical models to compute physical, chemical, or …

Molecular descriptors

V Consonni, R Todeschini - Recent advances in QSAR studies: methods …, 2010 - Springer
In the last decades, several scientific researches have been focused on studying how to
encompass and convert–by a theoretical pathway–the information encoded in the molecular …