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Predicting RP-LC retention indices of structurally unknown chemicals from mass spectrometry data.

Jim BoelrijkDenice van HerwerdenBernd EnsingPatrick ForréSaer Samanipour
Published in: J. Cheminformatics (2023)
Keyphrases
  • mass spectrometry data
  • pattern classification
  • high throughput
  • mass spectrometry
  • cancer classification
  • data sets
  • data mining
  • low cost
  • microarray