Comparing normalization methods and the impact of noise.
Thao VuEli RiekebergYumou QiuRobert PowersPublished in: Metabolomics : Official journal of the Metabolomic Society (2018)
PQ and CS performed the best at recovering peak intensities and reproducing the true classifying features for an OPLS-DA model regardless of spectral noise level. Our findings suggest that performance is largely determined by the level of noise in the dataset, while the effect of dilution factors was negligible. A minimal allowable noise level of 20% was also identified for a valid NMR metabolomics dataset.