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Please use this identifier to cite or link to this item: http://hdl.handle.net/1942/18987

Title: iMonDB: Mass Spectrometry Quality Control through Instrument Monitoring
Authors: Bittremieux, Wout
Willems, Hanny
Kelchtermans, Pieter
Martens, Lennart
Laukens, Kris
VALKENBORG, Dirk
Issue Date: 2015
Publisher: AMER CHEMICAL SOC
Citation: JOURNAL OF PROTEOME RESEARCH, 14 (5), p. 2360-2366
Abstract: Over the past few years, awareness has risen that for mass-spectrometry-based proteomics methods to mature into everyday analytical and clinical practices, extensive quality assessment is mandatory. A currently overlooked source of qualitative information originates from the Mass spectrometer itself. Apart from the actual mass spectral data, raw-data objects also Contain parameter settings and sensory information about the mass instrument. This information gives a detailed account of the operation of the instrument, which eventually can be related to observations in mass spectral data. The advantage of instrument information at the lowest level is the high sensitivity to detect emerging defects in a timely fashion. To this end, we introduce the Instrument MONitoring DataBase (iMonDB), which allows us to automatically extract, store, and manage the instrument parameters from raw-data objects into a highly efficient database structure. This enables us to monitor the instrument parameters over a considerable time period. Time course information about the instrument performance is necessary to define the normal range of operation and to detect anomalies that may correlate with instrument failure. The proposed tools foster an additional handle on quality control and are released as open source under the permissive Apache 2.0 license: The tools can be downloaded from https://bitbucket.org/proteinspector/imondb.
Notes: [Bittremieux, Wout; Laukens, Kris] Univ Antwerp, Dept Math & Comp Sci, B-2020 Antwerp, Belgium. [Bittremieux, Wout; Laukens, Kris] Univ Antwerp, Univ Antwerp Hosp, Biomed Informat Res Ctr Antwerp Biomina, B-2650 Edegem, Belgium. [Willems, Hanny; Kelchtermans, Pieter; Valkenborg, Dirk] Flemish Inst Technol Res VITO, BE-2400 Mol, Belgium. [Kelchtermans, Pieter; Martens, Lennart] Univ Ghent VIB, Dept Med Prot Res, B-9000 Ghent, Belgium. [Kelchtermans, Pieter; Martens, Lennart] Univ Ghent, Fac Med & Hlth Sci, Dept Biochem, B-9000 Ghent, Belgium. [Valkenborg, Dirk] Univ Antwerp, CFP, B-2020 Antwerp, Belgium. [Valkenborg, Dirk] Hasselt Univ, I BioStat, B-3590 Diepenbeek, Belgium.
URI: http://hdl.handle.net/1942/18987
DOI: 10.1021/acs.jproteome.5b00127
ISI #: 000354004700033
ISSN: 1535-3893
Category: A1
Type: Journal Contribution
Validation: ecoom, 2016
Appears in Collections: Research publications

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