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MS2Query: reliable and scalable MS(2) mass spectra-based analogue search

Metabolomics-driven discoveries of biological samples remain hampered by the grand challenge of metabolite annotation and identification. Only few metabolites have an annotated spectrum in spectral libraries; hence, searching only for exact library matches generally returns a few hits. An attractive...

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Detalles Bibliográficos
Autores principales:	de Jonge, Niek F., Louwen, Joris J. R., Chekmeneva, Elena, Camuzeaux, Stephane, Vermeir, Femke J., Jansen, Robert S., Huber, Florian, van der Hooft, Justin J. J.
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	Nature Publishing Group UK 2023
Materias:	Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10060387/ https://www.ncbi.nlm.nih.gov/pubmed/36990978 http://dx.doi.org/10.1038/s41467-023-37446-4

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