Analyysitekniikoita nestekromatografiaa/massaspektrometriaa varten

摘要

? method for analyzing liquid chromatography/spectrometry [="LC/MS"] data comprising the following steps: preparing (1-2) a plurality of sample runs; processing (1-4) each of the prepared sample runs in an LC/MS spectrometer to obtain a spectrum in respect of each processed sample run; internally representing (1-10) each spectrum as a layout of mass/charge versus retention time; performing a first peak detection (1-12) to detect peaks of each spectrum; internally aligning (1-14) the detected peaks of each spectrum; and performing a second peak detection (1-16) to detect peaks missed in the first peak detection.