MetaboID - RASpicer/MetabolomicsTools GitHub Wiki

MetaboID

- Deprecated

Version: 1

Website

http://rams.biop.lsa.umich.edu/research/metabolomics

Description

This program is designed to allow the comparison of the experimental spectra to those of authentic compound standards, with the aim of compound assignment. MetaboID is built upon a library of 360 unique small molecule spectra from BMRB and HMDB. It also allows input of a user-defined metabolite library. When a full-resolution spectrum is imported, it is normalised for intensity and the water and urea (4.5-6ppm) is set to 0 to eliminate the solvent signal.

Functionality

  • Annotation/NMR

Instrument Data Type

  • NMR/1H NMR

Approaches

Computer Skills

Advanced

Software Type

  • Package

Interface

  • Command line interface

Operating System (OS)

  • Unix/Linux
  • Mac OS
  • Windows

Language

MATLAB

Dependencies

Input Formats - Open

Input Formats - Proprietary

Published

2011

Last Updated

2011

License

Paper

http://www.ncbi.nlm.nih.gov/pubmed/23232331

PMID

23232331