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COLMARq: A Web Server for 2D NMR Peak Picking and Quantitative Comparative Analysis of Cohorts of Metabolomics Samples

[Image: see text] Highly quantitative metabolomics studies of complex biological mixtures are facilitated by the resolution enhancement afforded by 2D NMR spectra such as 2D (13)C–(1)H HSQC spectra. Here, we describe a new public web server, COLMARq, for the semi-automated analysis of sets of 2D HSQ...

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Detalles Bibliográficos
Autores principales: Li, Da-Wei, Leggett, Abigail, Bruschweiler-Li, Lei, Brüschweiler, Rafael
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2022
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9218957/
https://www.ncbi.nlm.nih.gov/pubmed/35672005
http://dx.doi.org/10.1021/acs.analchem.2c00891