2020
DOI: 10.3390/metabo10050186
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MetaboAnalystR 3.0: Toward an Optimized Workflow for Global Metabolomics

Abstract: Liquid chromatography coupled to high-resolution mass spectrometry platforms are increasingly employed to comprehensively measure metabolome changes in systems biology and complex diseases. Over the past decade, several powerful computational pipelines have been developed for spectral processing, annotation, and analysis. However, significant obstacles remain with regard to parameter settings, computational efficiencies, batch effects, and functional interpretations. Here, we introduce MetaboAnalystR 3.0, a si… Show more

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Cited by 445 publications
(344 citation statements)
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“…MetaboAnalystR 3.0 [ 51 ], statTarget2 [ 52 ] and Bioconductor package manager using R programming language [ 53 ], were used to perform statistical analyses. Quality control based signal correction was performed using random forest implementation (QC-RFSC) [ 54 ].…”
Section: Methodsmentioning
confidence: 99%
“…MetaboAnalystR 3.0 [ 51 ], statTarget2 [ 52 ] and Bioconductor package manager using R programming language [ 53 ], were used to perform statistical analyses. Quality control based signal correction was performed using random forest implementation (QC-RFSC) [ 54 ].…”
Section: Methodsmentioning
confidence: 99%
“…The statistical significance was evaluated with Student's t test or oneway analysis of variance. The heatmap was performed on Metaboanalyst (76).The results were considered as significant for a p value≤0.05. Secondary data analysis and correlation matrices were calculated using the open-source software GNU-R. Bacterial growth counts across all the tested scenarios as well as metrics related to each lipid composition (viz.…”
Section: Methodsmentioning
confidence: 99%
“…To explore if combining parameters of microglia morphology, phenotype and density could reveal different MS subgroups, we performed a principle component analysis (PCA) with scaling of the parameters using the web-based MetaboAnalyst (http:// www.metaboanalyst.ca) 47 . We included measures for microglia morphology and shape (AUC derived from the sholl analysis and soma size), microglia protein expression (P2Y12, TMEM119, CD68, HLA class II) and microglial density.…”
Section: Principal Component Analysismentioning
confidence: 99%