D. Ahila Jeyanthi*, T. M. Selvarajan
Intelligent Automation & Soft Computing, Vol.33, No.1, pp. 669-680, 2022, DOI:10.32604/iasc.2022.022187
Abstract The molecular structures are modelled as graphs which are called the molecular graphs. In these graphs, each vertex represents an atom and each edge denotes covalent bond between atoms. It is shown that the topological indices defined on the molecular graphs can reflect the chemical characteristics of chemical compounds and drugs. A large number of previous drug experiments revealed that there are strong inherent connections between the drug’s molecular structures and the bio-medical and pharmacology characteristics. The forgotten topological index is introduced to be applied into chemical compound and drug molecular structures, which is quite helpful for medical and pharmaceutical… More >
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