NMRProcFlow: a graphical and interactive tool dedicated to 1D spectra processing for NMR-based metabolomics

IntroductionConcerning NMR-based metabolomics, 1D spectra processing often requires an expert eye for disentangling the intertwined peaks.ObjectivesThe objective of NMRProcFlow is to assist the expert in this task in the best way without requirement of programming skills.MethodsNMRProcFlow was developed to be a graphical and interactive 1D NMR (1H & 13C) spectra processing tool.ResultsNMRProcFlow (http://nmrprocflow.org), dedicated to metabolic fingerprinting and targeted metabolomics, covers all spectra processing steps including baseline correction, chemical shift calibration and alignment.ConclusionBiologists and NMR spectroscopists can easily interact and develop synergies by visualizing the NMR spectra along with their corresponding experimental-factor levels, thus setting a bridge between experimental design and subsequent statistical analyses.

• Publication year

  2016

• Venue

  Metabolomics

• Publication date

  2016-11-23

• Fields of study

  Biology, Chemistry, Computer Science, Mathematics, Medicine

• Identifiers
  DOI 10.1007/s11306-017-1178-yarXiv 1611.07801PMID 28261014PMCID 5313591
• External record

  Open on Semantic Scholar

• Source metadata

  Semantic Scholar, PubMed

• No claims are published for this paper.

• No concepts are published for this paper.

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