MZedDB - RASpicer/MetabolomicsTools GitHub Wiki
MZedDB
Version: 1
Website
http://maltese.dbs.aber.ac.uk:8888/hrmet/index.html
Description
MZedDB is a database of potential adducts and neutral losses, that can be searched by sum formula, accurate mass, nominal mass or metabolite name. It can thus provide potential annotations for accurate mass, including the ability to predict the empirical formula, whilst taking into account adducts, neutral losses and isotopes. For database searches: KEGG, Metacyc and HMDB can be searched. The user can specify searches for metabolites found in a specific organism by interfacing with KEGG. MZedDB can be interfaced with R using a supplied script.
Functionality
- Annotation/MS/Level 4 - Unequivocal Molecular Formula
Instrument Data Type
- MS/LC-MS/LC-ESI-MS
Approaches
- Untargeted
Computer Skills
Basic
Software Type
- Web App
- R script
Interface
Web user interface
Operating System (OS)
- Unix/Linux
- Mac OS
- Windows
Language
MySQL, Perl, PHP, R
Dependencies
Input Formats - Open
m/z values
Input Formats - Proprietary
N/A
Published
2008
Last Updated
2009
License
Paper
http://www.ncbi.nlm.nih.gov/pubmed/19622150
PMID
19622150