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. 2023 Nov 10;71(46):18010–18023. doi: 10.1021/acs.jafc.3c03099

Table 1. MS Features-CAD Peaks Statistics (Positive Ionization).

  no filter peak-shape filter peak-shape filter and taxon filter
picked features 3161 3161 3161
picked CAD peaks 62 62 62
features linked to CAD peak 1181 392 136
number of features per peaka 19.0 7.4 3.0
number of structures per peaka 16.6 6.6 2.6
number of MFs per peaka 16.6 6.6 2.6
number of chemical classes per peaka 13.4 5.9 2.5
a

On average.