Chemical graph theory is the topology branch of mathematical chemistry which applies graph theory to mathematical modelling of chemical phenomena.The… (More)

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2017

2017

- Jack N. Averitt, Tabitha N. Williford, Hua Wang
- 2017

Chemical graph theory began as a way for mathematicians to bring together the areas of the Physical Sciences and Mathematics… (More)

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2015

2015

- David Amos, Yair Caro, Randy Davila, Ryan Pepper
- Discrete Applied Mathematics
- 2015

Given a simple undirected graph G and a positive integer k, the k-forcing number of G, denoted Fk(G), is the minimum number of… (More)

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Review

2013

Review

2013

The development of chemical applications of graph theory is reviewed from a personal perspective. Graph-theoretical methods for… (More)

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2010

2010

- Ali Reza Ashrafi, Tomislav Doslic, Asma Hamzeh
- Discrete Applied Mathematics
- 2010

Recently introduced Zagreb coindices are a generalization of classical Zagreb indices of chemical graph theory. We explore here… (More)

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Review

2008

Review

2008

- Sandi Klavžara
- 2008

A general description of the cut method is presented and an overview of its applications in chemical graph theory is given… (More)

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2007

2007

- Marcos Mandado, María J. González-Moa, Ricardo A. Mosquera
- Journal of Computational Chemistry
- 2007

Relations between aromaticity indices derived from chemical graph theory and those based on 6-center electron delocalization are… (More)

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2005

Review

2005

- Ivan Gutman, Sandi Klavzar
- 2005

Fibonacenes (zig-zag unbranched catacondensed benzenoid hydrocarbons) are a class of polycyclic conjugated systems whose… (More)

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2005

2005

- Elena V. Konstantinova
- GTIT-C
- 2005

Information theory has been used in various branches of science. During recent years it is applied extensively in chemical graph… (More)

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2004

2004

- Douglas J. Klein, José Luis Palacios, Milan Randic, Nenad Trinajstic
- Journal of Chemical Information and Modeling
- 2004

Simple random walks probabilistically grown step by step on a graph are distinguished from walk enumerations and associated… (More)

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2003

2003

- Artur Ratkiewicz, Thanh N. Truong
- Journal of Chemical Information and Computer…
- 2003

We present an application of the chemical graph theory approach for generating elementary reactions of complex systems. Molecular… (More)

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