diff iquant.xml @ 0:44077d92c836 draft

Initial commit.

--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/iquant.xml	Thu May 09 17:14:17 2013 -0400
@@ -0,0 +1,69 @@
+<tool id="iquant" name="iQuant" version="0.2.0">
+  <description>Perform quantitation on data labeled with isobaric tags.</description>
+  <command>
+    LTQ-iQuant-cli --report_type ${peptide_report.report_type} --group_type ${group_type} --report ${peptide_report.report} --type ${quant_type} --output $output
+    #for $input in $inputs:
+    "${input}"
+    #end for
+  </command>
+  <inputs>
+    <conditional name="peptide_report">
+      <param name="report_type" type="select" label="Identification Report Type">
+        <option value="PEPXML">PepXML</option>
+        <option value="SCAFFOLD">Scaffold Spectrum Report</option>
+        <option value="PROTEIN_PILOT">ProteinPilot Peptide Report</option>
+        <option value="MAX_QUANT">MaxQuant MSMS Export</option>
+      </param>
+      <when value="PEPXML">
+        <param format="pepxml" name="report" type="data" label="Input PepXML"/>
+      </when>
+      <when value="SCAFFOLD">
+        <param format="text" name="report" type="data" label="Input Scaffold Report"/>
+      </when>
+      <when value="PROTEIN_PILOT">
+        <param format="text" name="report" type="data" label="Input ProteinPilot Peptide Report"/>
+      </when>
+      <when value="MAX_QUANT">
+        <param format="text" name="report" type="data" label="Input MaxQuant MSMS Export"/>
+      </when>
+    </conditional>
+    <param name="inputs" multiple="true" type="data" format="mzxml,mzml" label="Peaklist(s)" help=""/>
+    <param name="quant_type" type="select" label="Quantification type">
+      <option value="FOUR_PLEX">iTRAQ 4-plex</option>
+      <option value="EIGHT_PLEX">iTRAQ 8-plex</option>
+      <option value="TMT_TWO_PLEX">TMT 2-plex</option>
+      <option value="TMT_SIX_PLEX">TMT 6-plex</option>
+    </param>
+    <param name="group_type" type="select" label="Quantify based on grouping of">
+      <option value="PROTEIN">Proteins</option>
+      <option value="PEPTIDE">Peptides</option>
+      <option value="PEPTIDE_WITH_MODIFICATIONS">Peptides with modifications</option>
+      <option value="PEPTIDE_WITH_UNIQUE_MODIFICATION">Peptide with an identified modification</option>
+    </param>
+  </inputs>
+
+  <outputs>
+    <data format="tabular" name="output" />
+  </outputs>
+
+  <requirements>
+    <requirement type="package" version="1.19.19">tint_proteomics_scripts</requirement><!-- Version 1.19.19 or higher -->
+  </requirements>
+
+  <help>
+**What it does**
+
+iQuant is a tool that performs tag based isobaric quantification by implementing a technique assigning collective reporter ion intensity-based weights to each peptide abundance ratio and calculating a protein's weighted average abundance ratio and p-value. 
+
+iQuant requires identification results from an upstream identification pipeline along with XML peak lists for the data (mzXML is well supported and an mzML option has been provided for testing). 
+
+------
+
+**Citation**
+
+For the underlying tool, please cite ``Onsongo G, Stone MD, Van Riper SK, Chilton J, Wu B, Higgins L, Lund TC, Carlis JV, Griffin TJ, 2010. LTQ-iQuant: A freely available software pipeline for automated and accurate protein quantification of isobaric tagged peptide data from LTQ instruments. Proteomics. 10(19).  doi: 10.1002/pmic.201000189.``
+
+If you use this tool in Galaxy, please cite Chilton J, et al. https://bitbucket.org/galaxyp/galaxyp-toolshed-iquant
+
+  </help>
+</tool>