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Building blocks for automated elucidation of metabolites: Machine learning methods for NMR prediction.

, , , and . BMC Bioinform., (2008)

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Computational Metabolomics (NII Shonan Meeting 2017-3)., , and . NII Shonan Meet. Rep., (2017)Ontologies for increasing the FAIRness of plant research data., , , , , , , , and . CoRR, (2023)Harmonising, Harvesting, and Searching Metadata Across a Repository Federation., , , , , , , , , and 4 other author(s). CoRDI, TIB Open Publishing, (2023)Digitalizing the Chemical Landscape: A Comprehensive Overview and Progress Report of NFDI4Chem., , , , , , , and . CoRDI, TIB Open Publishing, (2023)MetaboLights - an open-access general-purpose repository for metabolomics studies and associated meta-data., , , , , , , , , and 5 other author(s). Nucleic Acids Res., 41 (Database-Issue): 781-786 (2013)Building blocks for automated elucidation of metabolites: Machine learning methods for NMR prediction., , , and . BMC Bioinform., (2008)Towards standardized evidence descriptors for metabolite annotations., , and . ODLS, volume 1692 of CEUR Workshop Proceedings, page 1-5. CEUR-WS.org, (2016)Storage and Processing of Mass Spectrometry Data., and . DEXA Workshops, page 211-215. IEEE Computer Society, (2006)Database supported candidate search for Metabolite identification., , and . J. Integr. Bioinform., (2011)MetHouse: Raw and Preprocessed Mass Spectrometry Data., and . J. Integr. Bioinform., (2007)