A quantitative structure-activity relationship (QSAR) study of chlorinated cyclodiene insecticide analogs [PDF]
, 1995 Quantitative structure-activity relationships (QSAR) between the inhibitory effect of specific t-butylbicyclophosphorothionate (TBPS) binding to rat brain P2 membrane, a lipophilic parameter, and topological indices, were studied for 33 chlorinated ...
Jianbo Liu
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An assessment of mutagenicity of chemical substances by (quantitative) structure–activity relationship [PDF]
Genes and Environment, 2020 Currently, there are more than 100,000 industrial chemicals substances produced and present in our living environments. Some of them may have adverse effects on human health.
Masamitsu Honma
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3D-QSAR-based pharmacophore determination and design of novel DPP-4 inhibitors [PDF]
Scripta Medica, 2022 Background/Aim: Therapy of diabetes mellitus type 2 includes drugs that act as inhibitors of dipeptidyl peptidase 4 (DPP-4) enzyme. Several DPP-4 inhibitors are marketed today and although they have favourable safety profile and tolerability, they show ...
Rogić Sanja, Gagić Žarko
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Ranking-Oriented Quantitative Structure–Activity Relationship Modeling Combined with Assay-Wise Data Integration [PDF]
ACS Omega, 2021 Katsuhisa Matsumoto +2 more
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QSAR studies for the acute toxicity of nitrobenzenes to the Tetrahymena pyriformis [PDF]
Journal of the Serbian Chemical Society, 2014 Quantitative structure-activity relationship (QSAR) models play a key role in finding the relationship between molecular structures and the toxicity of nitrobenzenes to Tetrahymena pyriformis.
Wang Dan-Dan +3 more
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Development and Evaluation of Conformal Prediction Methods for Quantitative Structure–Activity Relationship [PDF]
ACS OmegaYuting Xu +3 more
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Design of cinnamaldehyde amino acid Schiff base compounds based on the quantitative structure–activity relationship [PDF]
Royal Society Open Science, 2017 Cinnamaldehyde amino acid Schiff base (CAAS) is a new class of safe, bioactive compounds which could be developed as potential antifungal agents for fungal infections.
Hui Wang +6 more
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Beni-Suef University Journal of Basic and Applied Sciences, 2020 Background Prostate cancer is the most common non-cutaneous cancer in males and accounts for about 4% of all cancer-related deaths in males annually.
Fabian A. Ikwu +2 more
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Correlation between the lipophilicity and antifungal activity of some benzoxazole derivatives [PDF]
Acta Periodica Technologica, 2010 In the present work, a quantitative relationship between the lipophilicity and antifungal activity of some benzoxazole derivatives against Candida albicans was investigated by using QSAR (quantitative structure-activity relationship) analyses.
Podunavac-Kuzmanović Sanja O. +1 more
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Quantitative Structure Activity Relationship Models for the Antioxidant Activity of Polysaccharides. [PDF]
PLoS ONE, 2016 In this study, quantitative structure activity relationship (QSAR) models for the antioxidant activity of polysaccharides were developed with 50% effective concentration (EC50) as the dependent variable.
Zhiming Li +3 more
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