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Betanidin pK(a) Prediction Using DFT Methods

[Image: see text] Betalains can be used in food, drugs, and cosmetic industries and have shown their bioactive potential. These properties are strongly influenced by pH and other physicochemical conditions. The pK(a) values for the polyprotic Betanidin (Bd) molecule are unknown, and they are crucial...

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Detalles Bibliográficos
Autores principales:	Rodriguez, Sergio A., Baumgartner, Maria T.
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	American Chemical Society 2020
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7301574/ https://www.ncbi.nlm.nih.gov/pubmed/32566840 http://dx.doi.org/10.1021/acsomega.0c00904

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