bio-metabolomics-xcms-preprocessing

Community

Preprocess LC-MS data with XCMS in R.

Authordailycafi
Version1.0.0
Installs0

System Documentation

What problem does it solve?

Preprocess raw LC-MS metabolomics data into a clean feature table by performing peak detection, retention-time alignment, peak grouping, and gap filling to enable robust downstream analysis.

Core Features & Use Cases

  • Peak detection using CentWave or MatchedFilter for LC-MS data across samples
  • Retention time alignment and grouping of features to build a consistent feature table
  • Gap filling and export-ready feature matrices for untargeted metabolomics
  • Use Case: Prepare data for downstream statistical analysis and metabolite annotation

Quick Start

Process mzML files with XCMS to generate a sample-by-feature table.

Dependency Matrix

Required Modules

None required

Components

Standard package

💻 Claude Code Installation

Recommended: Let Claude install automatically. Simply copy and paste the text below to Claude Code.

Please help me install this Skill:
Name: bio-metabolomics-xcms-preprocessing
Download link: https://github.com/dailycafi/metabolism-skills/archive/main.zip#bio-metabolomics-xcms-preprocessing

Please download this .zip file, extract it, and install it in the .claude/skills/ directory.
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