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Predicting proton titration in cationic micelle and bilayer environments

Knowledge of the protonation behavior of pH-sensitive molecules in micelles and bilayers has significant implications in consumer product development and biomedical applications. However, the calculation of pK(a)’s in such environments proves challenging using traditional structure-based calculation...

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Detalhes bibliográficos
Main Authors: Morrow, Brian H., Eike, David M., Murch, Bruce P., Koenig, Peter H., Shen, Jana K.
Formato: Artigo
Idioma:Inglês
Publicado em: American Institute of Physics 2014
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC4149686/
https://ncbi.nlm.nih.gov/pubmed/25173037
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1063/1.4893439
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