Mercurial > repos > marcel > caddsuite_mac10_6
diff CADDSuite-1.6/galaxyconfigs/tools/PropertyPlotter.xml @ 10:eda78e0f5df6 draft default tip
Deleted selected files
author | marcel |
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date | Sun, 30 Nov 2014 03:46:08 -0500 |
parents | 488032d372e1 |
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--- a/CADDSuite-1.6/galaxyconfigs/tools/PropertyPlotter.xml Sat Dec 15 13:16:40 2012 -0500 +++ /dev/null Thu Jan 01 00:00:00 1970 +0000 @@ -1,35 +0,0 @@ - -<!--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="propertyplotter" name="PropertyPlotter" version="1.6"> - <description>plot molecule properties</description> - <command interpreter="bash"><![CDATA[../../PropertyPlotter -#if str( $i ) != '' and str( $i ) != 'None' : - -i "$i" -#end if -#if str( $p1 ) != '' and str( $p1 ) != 'None' : - -p1 "$p1" -#end if -#if str( $p2 ) != '' and str( $p2 ) != 'None' : - -p2 "$p2" -#end if -#if str( $o ) != '' and str( $o ) != 'None' : - -o "$o" -#end if --quiet - | tail -n 5 -]]></command> - <inputs> - <param name="i" optional="false" label="input file" type="data" format="mol2/sdf/drf"/> - <param name="p1" optional="false" label="name of property 1" area="true" type="text" size="1x15"/> - <param name="p2" optional="true" label="Optional: name of property 2" area="true" type="text" size="1x15"/> - </inputs> - <outputs> - <data name="o" format="png"/> - </outputs> - <help>PropertyPlotter can be used to generate distribution- or scatter-plots of data contained in molecule property-tags. - -In case you want to create a scatter-plot, specify the name of both property-tags to be used with '-p1' and '-p2'. If you want to generate a distribution plot, just specify '-p1'. -The output graphic will created by use of gnuplot, so make sure to have it installed and in your PATH environment variable. - -The output of this tool is a plot in form of an eps or png-file (as chosen).</help> -</tool> \ No newline at end of file