@article{270699831271439fb437dfde13934250,
title = "metaboprep: an R package for pre-analysis data description and processing",
abstract = "MotivationMetabolomics is an increasingly common part of health research and there is need for preanalytical data processing. Researchers typically need to characterise the data and to exclude errors within the context of the intended analysis. While some pre-processing steps are common, there is currently a lack of standardization and reporting transparency for these procedures.ResultsHere we introduce metaboprep, a standardised data processing workflow to extract and characterise high quality metabolomics data sets. The package extracts data from pre-formed worksheets, provides summary statistics and enables the user to select samples and metabolites for their analysis based on a set of quality metrics. A report summarising quality metrics and theinfluence of available batch variables on the data is generated for the purpose of open disclosure. Where possible, we provide users flexibility in defining their own selection thresholds.Availability and implementationmetaboprep is an open-source R package available at https://github.com/MRCIEU/metaboprep",
keywords = "Metabolomics, mass spectrometry, nuclear magnetic resonance, evolutionary biology, epidemiology, cohort, pipeline, ALSPAC, BiB",
author = "Hughes, {David A} and Kurt Taylor and Mcbride, {Nancy S} and Matthew Lee and Dan Mason and Lawlor, {Debbie A} and Timpson, {Nicholas John} and Corbin, {Laura J}",
note = "Publisher Copyright: {\textcopyright} 2022 The Author(s) 2022. Published by Oxford University Press.",
year = "2022",
month = apr,
day = "1",
doi = "10.1093/bioinformatics/btac059",
language = "English",
volume = "38",
pages = "1980--1987",
journal = "Bioinformatics",
issn = "1367-4811",
publisher = "Oxford University Press",
number = "7",
}