Prioritizing Asthma Treatment Drugs through Multicriteria Decision Making

IF 1.5 4区化学 Q3 CHEMISTRY, ANALYTICAL

International Journal of Analytical Chemistry Pub Date : 2024-02-05 DOI:10.1155/2024/6516976

Sobia Sultana

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Abstract

Asthma is a medical condition characterized by inflammation, narrowing, and swelling of a person’s airways, leading to increased mucus production and difficulties in breathing. Topological indices are instrumental in assessing the physical and chemical attributes of these asthma drugs. As resistance to current treatments continues to emerge and undesirable side effects are linked to certain medications, the search for novel and enhanced drugs becomes a top priority. In this study, the examination of 19 distinct asthma medications was focused. In this study, quantitative structure-activity relationship (QSAR) and quantitative structure-property relationship (QSPR) modeling, in combination with multicriteria decision-making (MCDM) technique VIKOR (VIekriterijumsko KOmpromisno Rangiranje) were employed on asthma drugs, to achieve the most favorable rankings for each asthma drug, taking into account their distinct properties. The topological indices employed for QSPR modeling were Randic index, reciprocal Randic index, Zagreb indices, hyper-Zagreb index, harmonic index, geometric arithmetic index, and forgotten index.

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通过多标准决策确定哮喘治疗药物的优先次序

哮喘是一种以气道发炎、狭窄和肿胀为特征的疾病，会导致粘液分泌增多和呼吸困难。拓扑指数有助于评估这些哮喘药物的物理和化学属性。由于目前的治疗方法不断出现抗药性，而且某些药物会产生不良副作用，因此寻找新的增强型药物成为当务之急。本研究重点考察了 19 种不同的哮喘药物。本研究采用定量结构-活性关系（QSAR）和定量结构-性质关系（QSPR）建模，结合多标准决策（MCDM）技术 VIKOR（VIekriterijumsko KOmpromisno Rangiranje）对哮喘药物进行了分析，以根据每种哮喘药物的不同性质为其找出最有利的排名。QSPR 模型采用的拓扑指数包括兰迪克指数、倒数兰迪克指数、萨格勒布指数、超萨格勒布指数、谐波指数、几何算术指数和遗忘指数。

本文章由计算机程序翻译，如有差异，请以英文原文为准。

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来源期刊

International Journal of Analytical Chemistry CHEMISTRY, ANALYTICAL-

CiteScore

3.10

自引率

5.60%

发文量

117

期刊介绍： International Journal of Analytical Chemistry publishes original research articles that report new experimental results and methods, especially in relation to important analytes, difficult matrices, and topical samples. Investigations may be fundamental, or else related to specific applications; examples being biological, environmental and food testing, and analysis in chemical synthesis and materials processing. As well as original research, the International Journal of Analytical Chemistry also publishes focused review articles that examine the state of the art, identify emerging trends, and suggest future directions for developing fields.