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21st European Symposium on Quantitative Structure-Activity Relationship
Big Data Analysis Precision Medicine
2016/7/26
The EuroQSAR Symposia have been taking place since 1973 and constitute major scientific events in the field of computational drug design, with further applications in agricultural and environmental sc...
Adapting the Interrelated Two-way Clustering method for Quantitative Structure-Activity Relationship (QSAR) Modeling of a Diverse Set of Chemical Compounds
Mutagenicity topological indices atom pairs Interrelated Two-way Clustering ridge regression quantum chemical descriptors
2013/6/14
Interrelated Two-way Clustering (ITC) is an unsupervised clustering method developed to divide samples into two groups in gene expression data obtained through microarrays, selecting important genes s...
A structure-activity relationship study on the mechanisms of methacrylate-induced toxicity using NMR chemical shift of β-carbon, RP-HPLC log P and semiempirical molecular descriptor
Methacrylates Structure-activity relationships (SAR) Physicochemical properties
2009/9/11
To clarify the mechanism of methacrylate-induced toxicity, a total of 24 acrylates, methacrylates, and dimethacrylates were chosen for a structure-activity relationship (SAR) study in terms of NMR che...
Structure-Activity Relationship of Immunoregulatory Factors in Foodstuffs
allergy polyunsaturated fatty acids xanthene dyes
2009/7/7
The structure-activity relationship of allergy enhancing and suppressing factors in foodstuffs was summarized in this text. Polyunsaturated fatty acids (PUFA) enhance allergic response by enhancing Ig...
Studies on the Structure-Activity Relationship and Mode of Actions of Neonicotinoid Insecticides
neonicotinoids structure-activity relationship metabolism synergist electrophysiology
2009/3/7
The binding affinity of neonicotinoids for housefly head membranes was evaluated to elucidate the physicochemical features of the compounds involved in the ligand-nicotinic acetylcholine receptor (n...
Structure–activity relationship and mode of action study of insect growth regulators
insect growth regulators QSAR ecdysone receptors dibenzoylhydrazines Chilo suppressalis
2009/3/5
A number of N,N′-dibenzoyl-N-t-butylhydrazine analogs containing various substituted benzoyl moieties were synthesized and their biological activity was measured using various biological systems. La...
Synthesis and Antioxidant Activity of Modified (+)-Catechin Derivatives. Structure-Activity Relationship
Structure-Activity Relationship Modified
2008/11/26
In a screening program for free radical scavengers, new antioxidant compounds have been obtained by C-8 substitution of various groups on (+)-catechin A ring. Their preparation, purification, identifi...