Mercurial > repos > luis > ball
diff galaxy_stubs/PeptideBuilder.xml @ 2:605370bc1def draft default tip
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author | luis |
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date | Tue, 12 Jul 2016 12:33:33 -0400 |
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--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/galaxy_stubs/PeptideBuilder.xml Tue Jul 12 12:33:33 2016 -0400 @@ -0,0 +1,47 @@ +<?xml version='1.0' encoding='UTF-8'?> +<!--This is a configuration file for the integration of a tools into Galaxy (https://galaxyproject.org/). This file was automatically generated using CTD2Galaxy.--> +<!--Proposed Tool Section: [Preparation]--> +<tool id="PeptideBuilder" name="PeptideBuilder" version="1.1.0"> + <description>build a peptide </description> + <macros> + <token name="@EXECUTABLE@">PeptideBuilder</token> + <import>macros.xml</import> + </macros> + <expand macro="stdio"/> + <expand macro="requirements"/> + <command>PeptideBuilder + +#if $param_i: + -i $param_i +#end if +#if $param_o: + -o $param_o +#end if +</command> + <inputs> + <param name="param_i" type="data" format="txt" optional="False" value="<class 'CTDopts.CTDopts._Null'>" label="input torsion-file" help="(-i) "/> + </inputs> + <expand macro="advanced_options"/> + <outputs> + <data name="param_o" format="pdb"/> + </outputs> + <help>This tool creates a peptide by a given torsion file. The amino acids shall be given in three letter code, the phi, psi, and omega angles shall be given in degree. + +Example: + +# aa phi psi omega + +A -180 140 + +C -180 180 + +G -90 -140 + +P -65 -40 0 # cis + +T -120 -90 + +P -78 146 180 # trans + +</help> +</tool>