Improving global feature detectabilities through scan ...

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Improving global feature detectabilities through scan range splitting for untargeted metabolomics by high-performance liquid chromatography-Orbitrap mass spectrometry Christina Ranningera, Lukas E. Schmidta, Marc Rurikb,c, Alice Limoncield, Paul Jenningsd, Oliver Kohlbacherb,c,e,f,g, and Christian G. Hubera* a

Department of Molecular Biology, Division of Chemistry and Bioanalytics, University of

Salzburg, Salzburg, Austria, [email protected], [email protected], [email protected] b

Center for Bioinformatics, University of Tübingen, Tübingen, Germany, [email protected]

tuebingen.de, [email protected] c

Department of Computer Science, University of Tübingen, Germany

d

Department of Physiology and Medical Physics, Division of Physiology, Medical University of

Innsbruck, Innsbruck, 6020, Austria, [email protected], [email protected] e

f

Quantitative Biology Center, University of Tübingen, Germany

Faculty of Medicine, University of Tübingen, Germany

g

Biomolecular Interactions, Max Planck Institute for Developmental Biology, Tübingen, Germany

*Address correspondence to: Prof. Dr. Christian Huber Department of Molecular Biology, Division of Chemistry and Bioanalytics, University of Salzburg Hellbrunnerstraße 34, 5020 Salzburg, Austria Tel.:+43 (0)662-8044-5704, Fax: +43 (0)662-8044-5751 e-mail: [email protected] C. Ranninger et al.

Anal. Chim. Acta 930 (2016) 13-22

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