Saudi Pharmaceutical Journal (May 2017)

The first multiplication atom-bond connectivity index of molecular structures in drugs

  • Wei Gao,
  • Yiqiao Wang,
  • Weifan Wang,
  • Li Shi

Journal volume & issue
Vol. 25, no. 4
pp. 548 – 555

Abstract

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In the field of medicine, there are a large number of new drugs synthesis every year. Before entering the clinical stage, it needs a lot of work on drug testing of the various properties. Due to the lack of a large number of laboratory technician, laboratory equipment and reagents, the drug testing of many biochemical properties are not completed. Theoretical medicine provides a theoretical way for medical researchers to obtain the pharmaceutical properties of compounds by calculation tricks. In this paper, the first multiplication atom-bond connectivity index of several common drugs structure are studied, and the accurate expressions are determined. These theoretical conclusions provide practical guiding significance for pharmaceutical engineering. Keywords: Theoretical medicine, Molecular graph, Multiplicative atom-bond connectivity index, Dendrimer