Ou X#*., Wang X#., Zhao B., Zhao Y., Liu HQ., Chang Y., Wang Z., Yang W., Zhang X*., Yu K*. Metabolome and transcriptome signatures shed light on the anti-obesity effect of Polygonatum sibiricum. 2023, Frontiers in Plant Science., 14:1273.
Metabolomics data was processed using R packages: TidyMass.
From peak picking to metabolite annotation was completed using the HPC-TidyMass pipeline , in which only the peak picking step was utilized.
## The help information of Tidymass pipeline
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/home/data/shawn/01.src/02.script/02.Tidymass/runTidymass.sh: option requires an argument -- h
Tidymass pipeline part1. Date transform ,peak picking and annotation
Usage:
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runTidymass [-i input] [-t type] [-c column]
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Author Shawn Wang (shawnwang2016@126.com)
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Date Tus Feb 09, 2023
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Version V.0.0.0.99 beta
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Description
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[-i]:input, The file path of .raw data
[-t]:type, The type of ion model, 1: NEG+POS in one file, 2: NEG and POS in differnet files
[-c]:column, rp or hilic
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bash runTidymass.sh -i raw/p_sibiricum -t 1 -c rp
Step1. convert .raw data to .mzXML and .mgf
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.raw 2 .mzXML: 01.msconvert.sh
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.raw 2 .mgf: 03.ms2convert.sh
Step2. Data cleaning and normalization
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Raw data overview: OverviewMetabolomicsData.R
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Data cleaning and normalization: DataCleaning.R
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Data annotation: DataAnnotation.R
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Remove redundancy and classification: RemoveRedundancyandClassification.R
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Metabolomics Mfuzz: MetaMfuzz.R
Step3. Pacbio visualization
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Transcript annotation integration: PacbioVisualization.R
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Picbio BUSCO analysis: BUSCO.R
Step4. NGS data analysis
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DEG analysis and visualization, (hclust, 3D pca, DEG, mFuzz): DEG_analysis.R
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PSP pathway: PSP.R
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unFA pathway: unFA.R
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phloretin pathway: phloretin.R