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Article(4)
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European Journal of Medicinal Chemistry(2)
Bioorganic and Medicinal Chemistry(1)
SAR and QSAR in Environmental Research(1)
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Ingeniería química(2)
Química y ciencias afines(2)
Fisiología humana(1)
Ganadería(1)
Lesiones, enfermedades y plagas de las plantas(1)
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Relación cuantitativa estructura-actividad(4)
Bioquímica(3)
Farmacología(2)
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scopus(4)
QSAR modeling of the interaction of flavonoids with GABA(A) receptor
ArticleAbstract: Experimentally assigned values to binding affinity constants of flavonoid ligands towards the benzodPalabras claves:Benzodiazepine receptor, Dragon molecular descriptors, Flavone derivative, Flunitrazepam, GABA(A), QSAR, Replacement methodAutores:Autino J.C., Bennardi D.O., Castro E.A., Pablo R. Duchowicz, Romanelli G.P., Vitale M.G.Fuentes:scopusQSAR models for insecticidal properties of plant essential oils on the housefly (Musca domestica L.)
ArticleAbstract: The fumigant and topical activities exhibited by 27 plant-derived essentials oils (EOs) on adult M.Palabras claves:essential oils, Insecticidal activity, Molecular descriptors, Musca domesticaL, Quantitative structure-activity relationshipsAutores:Bennardi D.O., Comelli N.C., Ortiz E.V., Pablo R. DuchowiczFuentes:scopusQSAR on antiproliferative naphthoquinones based on a conformation- independent approach
ArticleAbstract: The antiproliferative activities of a series of 36 naphthoquinone derivatives were subjected to a QuPalabras claves:Cáncer, Molecular descriptors, Multivariable Linear Regression, Naphthoquinone derivative, QSAR TheoryAutores:Bacelo D.E., Bennardi D.O., Bonifazi E.L., Burton G., Misico R.I., Pablo R. Duchowicz, Padrón J.M., Rios-Luci C.Fuentes:scopusQSAR pbkp_rediction of inhibition of aldose reductase for flavonoids
ArticleAbstract: We performed a pbkp_redictive analysis based on quantitative structure-activity relationships (QSAR)Palabras claves:Aldose reductase inhibition, Cataract prevention, Dragon molecular descriptors, Enhanced replacement method, Flavone derivative, Genetic Algorithm, QSAR, Replacement methodAutores:Autino J.C., Bennardi D.O., Castro E.A., Fernandez F.M., Mercader A.G., Pablo R. Duchowicz, Romanelli G.P.Fuentes:scopus