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Table 2 Area Under Curves (AUCs) for all 5 methods.

From: MetaboHunter: an automatic approach for identification of metabolites from 1H-NMR spectra of complex mixtures

Data set

MH1_HMDB

MH1_MMCD

MH3_HMDB

MH3_MMCD

HMDB NMR Search

SYN5_s

0.835

0.636

0.653

0.484

0.516

SYN5_f

0.839

0.689

0.701

0.551

0

SYN5_p

0.890

0.849

0.663

0.589

0.739

EXP1

0.065

0.054

0.067

0.137

0.007

EXP2

0.170

0.171

0.221

0.153

0.264

  1. Data sets SYN5_s, SYN5_f and SYN5_p are synthetic mixtures and EXP1 and EXP2 are experimental mixtures. Each table cell contains the Area Under Curve (AUC) value calculated using the trapezoid rule [37].
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BMC Bioinformatics

ISSN: 1471-2105

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