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Improving sample classification by harnessing the potential of (1)H-NMR signal chemical shifts

NMR spectroscopy is a technology that is widely used in metabolomic studies. The information that these studies most commonly use from NMR spectra is the metabolite concentration. However, as well as concentration, pH and ionic strength information are also made available by the chemical shift of me...

Ausführliche Beschreibung

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Bibliographische Detailangaben
Veröffentlicht in:Sci Rep
Hauptverfasser: Cañueto, Daniel, Salek, Reza M., Correig, Xavier, Cañellas, Nicolau
Format: Artigo
Sprache:Inglês
Veröffentlicht: Nature Publishing Group UK 2018
Schlagworte:
Online Zugang:https://ncbi.nlm.nih.gov/pmc/articles/PMC6082897/
https://ncbi.nlm.nih.gov/pubmed/30089873
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/s41598-018-30351-7
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