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A Computationally Lightweight Algorithm for Deriving Reliable Metabolite Panel Measurements from 1D (1)H NMR

[Image: see text] Small Molecule Enhancement SpectroscopY (SMolESY) was employed to develop a unique and fully automated computational solution for the assignment and integration of (1)H nuclear magnetic resonance (NMR) signals from metabolites in challenging matrices containing macromolecules (here...

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Detalles Bibliográficos
Autores principales: Takis, Panteleimon G., Jiménez, Beatriz, Al-Saffar, Nada M. S., Harvey, Nikita, Chekmeneva, Elena, Misra, Shivani, Lewis, Matthew R.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2021
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8041249/
https://www.ncbi.nlm.nih.gov/pubmed/33733737
http://dx.doi.org/10.1021/acs.analchem.1c00113