home/categories/bioinformatics/gptomics-bioskills-metabolomics-xcms-preprocessing-skill-md
bioinformaticsresearch

bio-metabolomics-xcms-preprocessing

XCMS3 workflow for LC-MS/MS metabolomics preprocessing. Covers peak detection, retention time alignment, correspondence (grouping), and gap filling. Use when processing raw LC-MS data into a feature table for untargeted metabolomics.

GPTomics
maintainer
GPTomics
Actualizado 2/13/2026
Estrellas
471
Forks
81
quick start

Installation and usage

XCMS3 workflow for LC-MS/MS metabolomics preprocessing. Covers peak detection, retention time alignment, correspondence (grouping), and gap filling. Use when processing raw LC-MS data into a feature table for untargeted metabolomics.

Instalación
$ install --globalskills.sh
Uso

Después de instalarlo, puedes usar este skill ejecutando el siguiente comando en tu terminal:

skills use bio-metabolomics-xcms-preprocessing