Computational analyses of spectral trees from electrospray multi-stage mass spectrometry to aid metabolite identification

HIGHLIGHTS

  • who: Mingshu Cao and colleagues from the (UNIVERSITY) have published the paper: Computational Analyses of Spectral Trees from Electrospray Multi-Stage Mass Spectrometry to Aid Metabolite Identification, in the Journal: Metabolites 2013, 3, 1036-1050 of 16/Oct/2013
  • what: The authors demonstrate that the developed computation tools can be utilized for the systematic analysis of fragmentation data collected in various metabolomics platforms to aid peak annotation and metabolite identification. Given a specified m/z (m) tolerance (δ) that depends on the resolution of the mass spectrometer, the authors provide a function to group all ions . . .

     

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