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Nat Methods ; 17(9): 901-904, 2020 09.
Artículo en Inglés | MEDLINE | ID: mdl-32807955

RESUMEN

We present ReDU ( https://redu.ucsd.edu/ ), a system for metadata capture of public mass spectrometry-based metabolomics data, with validated controlled vocabularies. Systematic capture of knowledge enables the reanalysis of public data and/or co-analysis of one's own data. ReDU enables multiple types of analyses, including finding chemicals and associated metadata, comparing the shared and different chemicals between groups of samples, and metadata-filtered, repository-scale molecular networking.


Asunto(s)
Bases de Datos de Compuestos Químicos , Espectrometría de Masas , Metabolómica/métodos , Programas Informáticos , Metadatos , Modelos Químicos
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