@Article{broeckling_et_al:DagRep.12.5.1,
author = {Broeckling, Corey and Ebbels, Timothy and Math\'{e}, Ewy and Zamboni, Nicola and Wieder, Cecilia},
title = {{Computational Metabolomics: From Spectra to Knowledge (Dagstuhl Seminar 22181)}},
pages = {1--16},
journal = {Dagstuhl Reports},
ISSN = {2192-5283},
year = {2022},
volume = {12},
number = {5},
editor = {Broeckling, Corey and Ebbels, Timothy and Math\'{e}, Ewy and Zamboni, Nicola and Wieder, Cecilia},
publisher = {Schloss Dagstuhl -- Leibniz-Zentrum f{\"u}r Informatik},
address = {Dagstuhl, Germany},
URL = {https://drops.dagstuhl.de/entities/document/10.4230/DagRep.12.5.1},
URN = {urn:nbn:de:0030-drops-174410},
doi = {10.4230/DagRep.12.5.1},
annote = {Keywords: bioinformatics, cheminformatics, computational mass spectrometry, metabolite identification, computational metabolomics, machine learning, data integration, pathway analysis}
}