Computing Basis and Dimension of Chloroquine and Hydroxychloroquine by Using Chemical Graph Theory

被引:2
|
作者
Singh, Yogesh [1 ]
Raza, Hassan [2 ]
Sharma, Sunny Kumar [3 ]
Bhat, Vijay Kumar [3 ]
机构
[1] Shri Mata Vaishno Devi Univ, Sch Elect & Commun Engn, Katra, Jammu & Kashmir, India
[2] Wenzhou Kean Univ, Sch Math Sci, Coll Sci & Technol, Wenzhou, Peoples R China
[3] Shri Mata Vaishno Devi Univ, Sch Math, Katra, Jammu & Kashmir, India
关键词
Corona virus; chloroquine; hydroxychloroquine; metric dimension; topological index; independent set; METRIC DIMENSION; COVID-19; CORONAVIRUS; PREVENTION;
D O I
10.1080/10406638.2022.2086269
中图分类号
O62 [有机化学];
学科分类号
070303 ; 081704 ;
摘要
Discovering a vaccine with reliable and effective treatment for the new corona virus disease 2019 (COVID-19) is indeed a long way off, and there seems to be a critical need to research additional viable medications that could save countless lives in the event of the COVID-19 pandemic. Scientists from all over the world are actively developing medical or anti-virus medications, which are safe and effective for COVID-19. The anti-viral drugs of chloroquine (CQ) and hydroxychloroquine (HCQ) have proved to be an efficient inhibitory effect by preventing the binding of spike covid protein. The determination of a pharmaceutical structure using a topological index allows researchers to have a better understanding of the physiological as well as bio-organic properties of drugs. The goal of this study is to employ molecular graph theory to determine some graph-theoretic parameters related to the molecular graph of CQ and HCQ. In this paper, we present some resolvability parameters such as metric dimension (MD), edge metric dimension (EMD), fault-tolerant metric dimension (FTMD), and fault-tolerant edge metric dimension (FTEMD) of CQ and HCQ. We prove that these resolvability parameters for CQ and HCQ are bounded and constant.
引用
收藏
页码:4131 / 4147
页数:17
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