diff CADDSuite/galaxyconfigs/tools/MolPredictor.xml @ 5:b7a89b15646f

Uploaded
author marcel
date Tue, 12 Jul 2011 10:23:33 -0400
parents bac3c274238f
children
line wrap: on
line diff
--- a/CADDSuite/galaxyconfigs/tools/MolPredictor.xml	Tue Jun 28 10:37:20 2011 -0400
+++ b/CADDSuite/galaxyconfigs/tools/MolPredictor.xml	Tue Jul 12 10:23:33 2011 -0400
@@ -1,6 +1,6 @@
 
 <!--This is a configuration file for the integration of a CADDSuite tool into Galaxy (http://usegalaxy.org). This file was automatically generated using GalaxyConfigGenerator, so do not bother to make too many manual modifications.-->
-<tool id="molpredictor" name="MolPredictor" version="1.1">
+<tool id="molpredictor" name="MolPredictor" version="0.95">
     <description>predict molecule activities with QSAR model</description>
     <command interpreter="bash"><![CDATA[../../MolPredictor 
 #if str( $i ) != ''  and str( $i ) != 'None' :
@@ -30,13 +30,13 @@
  | tail -n 5
 ]]></command>
     <inputs>
-        <param name="i" label="input sd-file" optional="false" type="data" format="sdf"/>
-        <param name="mod" label="file containing QSAR model" optional="false" type="data" format="mod"/>
-        <param name="csv" label="input csv-file w/ additional descriptors" optional="true" type="data" format="csv"/>
-        <param name="csv_nr" label="no. of response variables in csv-file" optional="true" type="text" area="true" size="1x5" value=""/>
-        <param name="csv_sep" label="separator symbol in csv-file" optional="true" type="text" area="true" size="1x5" value=""/>
-        <param name="csv_cl" label="csv-file has compound (row) labels" optional="true" type="boolean" truevalue="true" falsevalue=""/>
-        <param name="csv_dl" label="csv-file has descriptor (column) labels" optional="true" type="boolean" truevalue="true" falsevalue=""/>
+        <param name="i" optional="false" label="input sd-file" type="data" format="sdf"/>
+        <param name="mod" optional="false" label="file containing QSAR model" type="data" format="mod"/>
+        <param name="csv" optional="true" label="input csv-file w/ additional descriptors" type="data" format="csv"/>
+        <param name="csv_nr" optional="true" label="Optional: no. of response variables in csv-file" type="text" area="true" size="1x5" value=""/>
+        <param name="csv_sep" optional="true" label="Optional: separator symbol in csv-file" type="text" area="true" size="1x5" value=""/>
+        <param name="csv_cl" optional="true" label="csv-file has compound (row) labels" type="boolean" truevalue="true" falsevalue=""/>
+        <param name="csv_dl" optional="true" label="csv-file has descriptor (column) labels" type="boolean" truevalue="true" falsevalue=""/>
     </inputs>
     <outputs>
         <data name="o" format="sdf"/>