Results 21 to 30 of about 322,559 (240)
Data in Brief, 2017 Fragment based Quantitative structure activity relationship (QSAR) analysis on reported 25 2-(2-(4-aryloxybenzylidene) hydrazinyl) benzothiazole dataset as antitubercular agents were carried out.
Amit S. Tapkir +2 more
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Quantitative Structure–Activity Relationship Modeling of Kinase Selectivity Profiles
Molecules, 2017 The discovery of selective inhibitors of biological target proteins is the primary goal of many drug discovery campaigns. However, this goal has proven elusive, especially for inhibitors targeting the well-conserved orthosteric adenosine triphosphate ...
Sandeepkumar Kothiwale +3 more
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A machine learning approach in predicting mosquito repellency of plant – derived compounds
Nova Biotechnologica et Chimica, 2018 The increasing prevalence of mosquito – borne diseases has prompted intensified efforts in the prevention of being bitten by the vector. Among the various strategies of vector control, the application of repellents provides instant and effective ...
Janairo Jose Isagani B. +2 more
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Prediction of the inhibitory activity of benzimidazole derivatives against Bacillus spp. [PDF]
Acta Periodica Technologica, 2011 In the present paper, the antibacterial activity of some 1-benzylbenzimidazole derivatives was evaluated against Gram-positive bacteria Bacillus spp. by using QSAR (quantitative structure-activity relationship). The tested compounds displayed in vitro
Podunavac-Kuzmanovića Sanja O. +2 more
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Quantitative structure-activity relationships to predict antibacterial effect of some benzimidazole derivatives [PDF]
Acta Periodica Technologica, 2008 The antibacterial activity of some substituted benzimidazole derivatives against Gram negative bacteria Escherichia coli was investigated. The tested compounds displayed in vitro inhibitory activity and their minimum inhibitory concentrations were ...
Podunavac-Kuzmanović Sanja O. +2 more
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Chemosensors, 2023 The development of organelle-specific fluorescent probes has been impeded by the absence of a comprehensive understanding of the relationship between the physicochemical properties of fluorescent probes and their selectivity towards specific organelles ...
Seong-Hyeon Park +4 more
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Molecules, 2021 The assertion made by Wu et al. that aromaticity may have considerable implications for molecular design motivated us to use nucleus-independent chemical shifts (NICS) as an aromaticity criterion to evaluate the antifungal activity of two series of indol-
María de los Ángeles Zermeño-Macías +7 more
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Quantitative Structure Activity Relationship of Cinnamaldehyde Compounds against Wood-Decaying Fungi
Molecules, 2016 Cinnamaldehyde, of the genius Cinnamomum, is a major constituent of the bark of the cinnamon tree and possesses broad-spectrum antimicrobial activity.
Dongmei Yang +3 more
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Molecules, 2018 Once applied, an herbicide first makes contact with leaves and soil. It is known that photolysis can be one of the most important processes of dissipation of herbicides in the field.
Juan J. Villaverde +4 more
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Molecules, 2017 Diterpenoid alkaloids are extracted from plants. These compounds have broad biological activities, including effects on the cardiovascular system, anti-inflammatory and analgesic actions, and anti-tumor activity.
Xiao Li +4 more
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