goldenRulesScore | R Documentation |
Percentage scores for molecular formula plausibility based on Rules 2, 4, 5 and 6 of Kind et al 2007.
goldenRulesScore(golden_rules)
golden_rules |
a tibble containing golden rule heuristic checks results as from |
A tibble containing golden rules plausibility percentage scores.
Kind, T. and Fiehn, O., 2007. Seven Golden Rules for heuristic filtering of molecular formulas obtained by accurate mass spectrometry. BMC bioinformatics, 8(1), pp.1-20.
c('H2O','C12H22O11') %>% goldenRules() %>% goldenRulesScore()
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