2003
DOI: 10.1021/ac0301806
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A Universal Denoising and Peak Picking Algorithm for LC−MS Based on Matched Filtration in the Chromatographic Time Domain

Abstract: A new denoising and peak picking algorithm (MEND, matched filtration with experimental noise determination) for analysis of LC-MS data is described. The algorithm minimizes both random and chemical noise in order to determine MS peaks corresponding to sample components. Noise characteristics in the data set are experimentally determined and used for efficient denoising. MEND is shown to enable low-intensity peaks to be detected, thus providing additional useful information for sample analysis. The process of d… Show more

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Cited by 133 publications
(122 citation statements)
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“…Most of the literature on peak picking (e.g. Li et al, 1995;Andreev et al, 2003), in fact, deals with the problem of estimating the peaks (local maxima) of a process affected by noise. Smoothing methods are employed to eliminate the effect of the noise fluctuations, preserving the shape of the "clean" process.…”
Section: Methodsmentioning
confidence: 99%
“…Most of the literature on peak picking (e.g. Li et al, 1995;Andreev et al, 2003), in fact, deals with the problem of estimating the peaks (local maxima) of a process affected by noise. Smoothing methods are employed to eliminate the effect of the noise fluctuations, preserving the shape of the "clean" process.…”
Section: Methodsmentioning
confidence: 99%
“…The signal should also be denoised to decrease the influence of interference and smooth the vibration curve. 21 In this study, the vibration signal was processed using the averaging method, which is based on the following formula…”
Section: Data Pre-processingmentioning
confidence: 99%
“…This fact has been used by a series of algorithms designed to purge chemical noise from this type of data. Andreev et al (2003) smoothed the time domain in LC-MS data using a matched filtering technique, which suppresses the additive noise in the Fourier domain taking into account its frequency characteristics. The component detection algorithm (CODA) by Windig, Phalp, and Payne (1996) calculated statistical descriptors to discard masses showing noisy elution profiles.…”
Section: Smoothing and Noise Estimationmentioning
confidence: 99%