Skip to main content
This is a pre-production deployment of Warehouse. Changes made here affect the production instance of PyPI (pypi.python.org).
Help us improve Python packaging - Donate today!

Python wrapper of metfrag for ms/ms based identification of LCMS data

Project Description

This libraries wraps Metfrag. It needs pandas installed and works nicley with emzed, though emhed is not mandatory.

MetFrag is a freely available software for the annotaion of high precision tandem mass spectra of metabolites which is a first and critical step for the identification of a molecule’s structure. Candidate molecules of different databases are fragmented in silico and matched against mass to charge values. A score calculated using the fragment peak matches gives hints to the quality of the candidate spectrum assignment.

Release History

Release History

History Node

0.5.1

History Node

0.5.0

History Node

0.4.4

History Node

0.4.3

History Node

0.4.2

History Node

0.4.1

History Node

0.4.0

History Node

0.3.0

History Node

0.2.0

History Node

0.1.0

History Node

0.0.2

This version
History Node

0.0.1

Supported By

WebFaction WebFaction Technical Writing Elastic Elastic Search Pingdom Pingdom Monitoring Dyn Dyn DNS Sentry Sentry Error Logging CloudAMQP CloudAMQP RabbitMQ Heroku Heroku PaaS Kabu Creative Kabu Creative UX & Design Fastly Fastly CDN DigiCert DigiCert EV Certificate Rackspace Rackspace Cloud Servers DreamHost DreamHost Log Hosting