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Anja Doebbe

dblp:144/2179 · DBLP profile ↗
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1ranked-venue papers
0as first author
0since 2021 · last 2014
—ORCID · none

Domains — the database's venue-derived domains; a paper can count in several

Applied, interdisciplinary, general and emerging computing · 1

Expertise — from the expertise taxonomy: the topics of the expert's papers under the CCF categories. A weight counts papers with recency: 1 for a paper about the topic, 0.3 when the topic is its context, halved every five years.

Interdisciplinary, comprehensive, and emerging computing
1 paper
Bioinformatics and computational biology · 100%

Topics — the 2 heaviest of 3, each with the papers that count most for it

TopicWeightPapersLastEvidence papers
Bioinformatics and computational biology
metabolomics
0.212014
BiPACE 2D - graph-based multiple alignment for comprehensive 2D gas chromatography-mass spectrometry · Bioinform. 2014
Bioinformatics and computational biology › metabolomics
peak alignment
0.212014
BiPACE 2D - graph-based multiple alignment for comprehensive 2D gas chromatography-mass spectrometry · Bioinform. 2014

Methods — techniques the papers use, named apart from their topics

graph-based alignment · 0.2
YearPublicationVenuePosition
2014 BiPACE 2D - graph-based multiple alignment for comprehensive 2D gas chromatography-mass spectrometry
abstract
MOTIVATION: Comprehensive 2D gas chromatography-mass spectrometry is an established method for the analysis of complex mixtures in analytical chemistry and metabolomics. It produces large amounts of data that require semiautomatic, but preferably automatic handling. This involves the location of significant signals (peaks) and their matching and alignment across different measurements. To date, there exist only a few openly available algorithms for the retention time alignment of peaks originating from such experiments that scale well with increasing sample and peak numbers, while providing reliable alignment results. RESULTS: We describe BiPACE 2D, an automated algorithm for retention time alignment of peaks from 2D gas chromatography-mass spectrometry experiments and evaluate it on three previously published datasets against the mSPA, SWPA and Guineu algorithms. We also provide a fourth dataset from an experiment studying the H2 production of two different strains of Chlamydomonas reinhardtii that is available from the MetaboLights database together with the experimental protocol, peak-detection results and manually curated multiple peak alignment for future comparability with newly developed algorithms. AVAILABILITY AND IMPLEMENTATION: BiPACE 2D is contained in the freely available Maltcms framework, version 1.3, hosted at http://maltcms.sf.net, under the terms of the L-GPL v3 or Eclipse Open Source licenses. The software used for the evaluation along with the underlying datasets is available at the same location. The C.reinhardtii dataset is freely available at http://www.ebi.ac.uk/metabolights/MTBLS37.
Nils Hoffmann, Mathias Wilhelm 0001, Anja Doebbe, Karsten Niehaus, Jens Stoye
Bioinform.3