机译:Classification of samples from NMR-based metabolomics using principal components analysis and partial least squares with uncertainty estimation
Chemical Sciences Division, Hollings Marine Laboratory, National Institute of Standards and Technology;
Chemical Sciences Division, National Institute of Standards and Technology;
Division of Chemical Metrology, National Institute of Metrology, Quality and Technology -INMETRO;
Metabolomics; Reliability; Bootstrap; Uncertainty estimation; Chemometrics; Biomarker discovery;