pyopenms

Analyze mass spectrometry data for proteomics and metabolomics workflows.

8|Updated Jan 13, 2026
One-click install
npx skills add https://github.com/hxk622/TokenDance --skill pyopenms-hxk622
Or copy as Structured Prompt for Agent
Please help me install this Agent Skill.
Skill: pyopenms
Source: https://github.com/hxk622/TokenDance/tree/main/backend/app/skills/builtin/scientific/research-tools/pyopenms
Command: npx skills add https://github.com/hxk622/TokenDance --skill pyopenms-hxk622

SYSTEM DOCUMENTATION & REQUIREMENTS

💡 This Skill requires pyopenms, and includes scripts (resource) and references (resource) components.

What problem does it solve?

This Skill provides a comprehensive platform for analyzing complex mass spectrometry data, streamlining proteomics and metabolomics workflows from raw data to identification and quantification.

Core Features & Use Cases

  • Data Processing: Handles extensive file formats (mzML, mzXML, etc.) and performs signal processing, feature detection, and quantification.
  • Identification & Annotation: Integrates with search engines for peptide/protein identification and supports metabolite annotation.
  • Use Case: Researchers can use this Skill to process raw LC-MS/MS data, identify thousands of peptides, quantify protein abundance across multiple samples, and annotate detected metabolites with confidence.

Quick Start

Use the pyopenms skill to load the file 'data.mzML' and print the number of spectra.

Frequently Asked Questions about pyopenms

High-intent search queries and answers about installing and using this skill.

FAQPage Schema
How do I process raw mass spectrometry data for proteomics and metabolomics workflows?

To process raw mass spectrometry data, you can load standard formats like mzML or mzXML to perform signal processing, feature detection, and quantification for comprehensive proteomics and metabolomics analysis.

What is the best way to identify and quantify peptides from LC-MS/MS data?

The best way to identify and quantify peptides from LC-MS/MS data is by using a platform that integrates with search engines to identify thousands of peptides and quantify protein abundance across multiple samples.

How does metabolite annotation work for mass spectrometry data?

Metabolite annotation for mass spectrometry data works by integrating with metabolomics databases, allowing you to annotate detected metabolites with confidence after initial signal processing and feature detection.

Can I analyze large scale mzML files for both proteomics and metabolomics?

Yes, you can analyze large scale mzML files for both proteomics and metabolomics, as the platform supports extensive file formats and handles complete workflows from raw data loading to identification and quantification.

Do I need specific search engines to identify proteins from mass spectrometry data?

You need to integrate with search engines to identify proteins from mass spectrometry data, as the platform relies on these external integrations for accurate peptide and protein identification.

What file formats are supported for mass spectrometry signal processing?

Supported file formats for mass spectrometry signal processing include mzML, mzXML, and other extensive formats, enabling you to load raw data and perform feature detection and quantification.