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Non-Linear Quantitative Structure–Activity Relationships Modelling, Mechanistic Study and In-Silico Design of Flavonoids as Potent Antioxidants

In this work, we developed quantitative structure–activity relationships (QSAR) models for prediction of oxygen radical absorbance capacity (ORAC) of flavonoids. Both linear (partial least squares—PLS) and non-linear models (artificial neural networks—ANNs) were built using parameters of two well-es...

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Detalhes bibliográficos
Publicado no:Int J Mol Sci
Main Authors: Žuvela, Petar, David, Jonathan, Yang, Xin, Huang, Dejian, Wong, Ming Wah
Formato: Artigo
Idioma:Inglês
Publicado em: MDPI 2019
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC6539043/
https://ncbi.nlm.nih.gov/pubmed/31083440
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/ijms20092328
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