LipidXplorer
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LipidXplorer is an uniqe software to identify lipids from high to low resolution mass spectra. Instrument created to identify lipids.
Usage: mzWiff.exe [options] <wiff file path> [<output file>]
Information options=
-I"<str>" where str specifies the ionisation used
-T"<str>" where str specifies the mass spectrometry type
-D"<str>" where str specifies detector used
-G use information recorded in wiff file; default off
mzXML is a XML (eXtensible Markup Language) based common file format for mass spectrometric data.
Usage: ReAdW [options] <raw file path> [<output file>]
Options
--mzXML: mzXML mode (default)
--mzML: mzML mode (will use msconvert)
one of --mzXML or --mzML must be selected
MFQL scripts are used for lipid identification, after the spectra data was imported. The GUI panel 'Run' is used to do so.
MFQL is designed to identify molecules out of mass spectrometric data given as experimental database as the MasterScan.
Requirements:
* Python
The license of this software is Free, you can free download and free use this database management software.