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Automated pathway and reaction prediction facilitates in silico identification of unknown metabolites in human cohort studies.
Quell JD, Römisch-Margl W, Colombo M, Krumsiek J, Evans AM, Mohney R, Salomaa V, de Faire U, Groop LC, Agakov F, Looker HC, McKeigue P, Colhoun HM, Kastenmüller G. Quell JD, et al. J Chromatogr B Analyt Technol Biomed Life Sci. 2017 Dec 15;1071:58-67. doi: 10.1016/j.jchromb.2017.04.002. Epub 2017 Apr 4. J Chromatogr B Analyt Technol Biomed Life Sci. 2017. PMID: 28479069 Free article.
The Pharmacogenetic Footprint of ACE Inhibition: A Population-Based Metabolomics Study.
Altmaier E, Menni C, Heier M, Meisinger C, Thorand B, Quell J, Kobl M, Römisch-Margl W, Valdes AM, Mangino M, Waldenberger M, Strauch K, Illig T, Adamski J, Spector T, Gieger C, Suhre K, Kastenmüller G. Altmaier E, et al. PLoS One. 2016 Apr 27;11(4):e0153163. doi: 10.1371/journal.pone.0153163. eCollection 2016. PLoS One. 2016. PMID: 27120469 Free PMC article.
KNIME4NGS: a comprehensive toolbox for next generation sequencing analysis.
Hastreiter M, Jeske T, Hoser J, Kluge M, Ahomaa K, Friedl MS, Kopetzky SJ, Quell JD, Mewes HW, Küffner R. Hastreiter M, et al. Among authors: quell jd. Bioinformatics. 2017 May 15;33(10):1565-1567. doi: 10.1093/bioinformatics/btx003. Bioinformatics. 2017. PMID: 28069593