Mercurial > repos > marcel > caddsuite_mac10_6
view CADDSuite-1.6/galaxyconfigs/tools/Converter.xml @ 9:488032d372e1 draft
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author | marcel |
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date | Sat, 15 Dec 2012 13:16:40 -0500 |
parents | dbb480e39d95 |
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<!--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="converter" name="Converter" version="1.6"> <description>interconvert molecular file-formats</description> <command interpreter="bash"><![CDATA[../../Converter #if str( $i ) != '' and str( $i ) != 'None' : -i "$i" #end if #if str( $o ) != '' and str( $o ) != 'None' : -o "$o" #end if #if str( $f ) != '' and str( $f ) != 'None' : -f "$f" #end if #if str( $rm ) != '' and str( $rm ) != 'None' : -rm #end if | tail -n 5 ]]></command> <inputs> <param name="i" optional="false" label="input file" type="data" format="mol2/sdf/drf"/> <param name="f" optional="true" label="output format" type="select"> <option value="mol2">mol2</option> <option value="sdf">sdf</option> <option value="drf">drf</option> <option value="pdb">pdb</option> <option value="ac">ac</option> <option value="ent">ent</option> <option value="brk">brk</option> <option value="hin">hin</option> <option value="mol">mol</option> <option value="xyz">xyz</option> <option value="mol2.gz">mol2.gz</option> <option value="sdf.gz">sdf.gz</option> <option value="drf.gz">drf.gz</option> <option value="pdb.gz">pdb.gz</option> <option value="ac.gz">ac.gz</option> <option value="ent.gz">ent.gz</option> <option value="brk.gz">brk.gz</option> <option value="hin.gz">hin.gz</option> <option value="mol.gz">mol.gz</option> <option value="xyz.gz">xyz.gz</option> </param> <param name="rm" optional="true" label="remove input file when finished" type="boolean" truevalue="true" falsevalue=""/> </inputs> <outputs> <data name="o" format="mol2/sdf/drf"> <change_format> <when input="f" value="mol2" format="mol2"/> <when input="f" value="sdf" format="sdf"/> <when input="f" value="drf" format="drf"/> <when input="f" value="pdb" format="pdb"/> <when input="f" value="ac" format="ac"/> <when input="f" value="ent" format="ent"/> <when input="f" value="brk" format="brk"/> <when input="f" value="hin" format="hin"/> <when input="f" value="mol" format="mol"/> <when input="f" value="xyz" format="xyz"/> <when input="f" value="mol2.gz" format="mol2.gz"/> <when input="f" value="sdf.gz" format="sdf.gz"/> <when input="f" value="drf.gz" format="drf.gz"/> <when input="f" value="pdb.gz" format="pdb.gz"/> <when input="f" value="ac.gz" format="ac.gz"/> <when input="f" value="ent.gz" format="ent.gz"/> <when input="f" value="brk.gz" format="brk.gz"/> <when input="f" value="hin.gz" format="hin.gz"/> <when input="f" value="mol.gz" format="mol.gz"/> <when input="f" value="xyz.gz" format="xyz.gz"/> </change_format> </data> </outputs> <help>This tool can be used to convert between different molecular file-formats. Supported formats are mol2, sdf, drf, pdb, ac, ent, brk, hin, mol, xyz, mol2.gz, sdf.gz, drf.gz, pdb.gz, ac.gz, ent.gz, brk.gz, hin.gz, mol.gz, xyz.gz.</help> </tool>