LDA - RASpicer/MetabolomicsTools GitHub Wiki
LDA
Version: 1.6.2
Website
http://genome.tugraz.at/lda/lda_description.shtml
Description
Lipid Data Analyser (LDA) peak picks LC-MS lipidomics data by a novel algorithm designed for accurate quantification. Firstly a chromatograph is extracted and the time-point at peak summit is identified. Next a m/z range is extracted around this narrow time point. The peak summit is then redetermined and the border points of the profile peaks are detected and an ellipse fitted. It uses theoretical isotope distribution as an exclusion criteria. There is no deisotopic step. Three standardisation methods are available: based on a single standard, a median method and internally developed methodology (standardisation by most robust standards).
Functionality
- Preprocessing
Instrument Data Type
- MS/LC-MS
Approaches
- Lipidomics
Computer Skills
Medium
Software Type
Package
Interface
Graphical user interface
Operating System (OS)
- Unix/Linux
- Mac OS
- Windows
Language
Java
Dependencies
N/A
Input Formats - Open
mzXML
Input Formats - Proprietary
Thermo Fisher Scientific .raw, waters .raw
Published
2010
Last Updated
2013
License
Academic users only
Paper
http://www.ncbi.nlm.nih.gov/pubmed/21169379
PMID
21169379