Multiplicative degree based topological indices of some chemical structures in drug

Authors

DOI:

https://doi.org/10.22199/issn.0717-6279-2020-05-0082

Keywords:

Topological index, Dox-loaded micelle comprising PEGPAsp block copolymer with chemically conjugated Dox SP[n], Polyomino chain of n-cycles; Triangular benzenoid (Tn), Circumcoronene benzenoid series (Hk)

Abstract

In quantitative structure property relationship analysis (QSPR) and quantitative structure property relationship analysis (QSAR) the correlation between different properties/activities and molecular structure of chemical compounds is investigated which is helpful in drug design. Topological index is an useful tool to predict different physical and chemical properties of molecule by collecting information from the molecular graph. In this article, multiplicative degree based topological indices are obtained for some chemical structures widely used in drug design, especially in anticancer drug discovery. To visualize the indices, the results are interpreted graphically.

Author Biographies

Murat Cancan, Van Yüzüncü Yıl University.

Faculty of Education

Sourav Mondal, National Institute of Technology Durgapur.

Dept. of mathematics.

Nilanjan De, Calcutta Institute of Engineering and Management.

Dept. of Basic Sciences and Humanities (Mathematics)

Anita Pal, National Institute of Technology Durgapur.

Dept. of mathematics.

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Published

2020-10-01

How to Cite

[1]
M. Cancan, S. Mondal, N. De, and A. Pal, “Multiplicative degree based topological indices of some chemical structures in drug”, Proyecciones (Antofagasta, On line), vol. 39, no. 5, pp. 1347-1364, Oct. 2020.

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