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Readme_IQ.txt
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Readme_IQ.txt
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Informed Quantitation (IQ) is a suite of algorithms for finding and quantifying peptides
in LC-MS/MS datasets. The IQ approach utilizes a list of peptides (or metabolites or
anything for which an empirical formula is known) and searches for each candidate in
one or more datasets. IQ looks at several factors when considering which isotopic
peaks can be attributed to a peptide.
IQ can read the following file formats. However, some of the file formats require that you
install the vendor-supplied data browsing software so that IQ has access to the necessary DLLs.
* mzXML files
* mzML files
* mz5 files
* Thermo Finnigan .Raw files (requires Xcalibur or MSFileReader)
* Download MSFileReader from http://sjsupport.thermofinnigan.com/public/detail.asp?id=703
* When the installer offers you the option of the version to install, be sure to install the 32-bit version.
* Agilent .Wiff files (requires Analyst)
* Agilent .D folders (requires Chemstation)
* Micromass files (requires MassLynx)
* Bruker acqu files
* IMS .IMF and .UIMF files
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Written by Gordon Slysz, Kevin Crowell, and Sam Payne for the Department of Energy (PNNL, Richland, WA)
E-mail: samuel.payne@pnnl.gov or matthew.monroe@pnnl.gov
Website: http://panomics.pnnl.gov/ or http://omics.pnl.gov
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Licensed under the Apache License, Version 2.0; you may not use this file except
in compliance with the License. You may obtain a copy of the License at
http://www.apache.org/licenses/LICENSE-2.0
All publications that result from the use of this software should include
the following acknowledgment statement:
Portions of this research were supported by the W.R. Wiley Environmental
Molecular Science Laboratory, a national scientific user facility sponsored
by the U.S. Department of Energy's Office of Biological and Environmental
Research and located at PNNL. PNNL is operated by Battelle Memorial Institute
for the U.S. Department of Energy under contract DE-AC05-76RL0 1830.
Notice: This computer software was prepared by Battelle Memorial Institute,
hereinafter the Contractor, under Contract No. DE-AC05-76RL0 1830 with the
Department of Energy (DOE). All rights in the computer software are reserved
by DOE on behalf of the United States Government and the Contractor as
provided in the Contract. NEITHER THE GOVERNMENT NOR THE CONTRACTOR MAKES ANY
WARRANTY, EXPRESS OR IMPLIED, OR ASSUMES ANY LIABILITY FOR THE USE OF THIS
SOFTWARE. This notice including this sentence must appear on any copies of
this computer software.