Mercurial > repos > guerler > spring_model
view spring_model.xml @ 2:3fd0f313665b draft default tip
"planemo upload commit fe7295ad48151648562b06d5b075a68d77747326"
author | guerler |
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date | Thu, 08 Apr 2021 18:23:33 +0000 |
parents | 719931bce361 |
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<tool id="spring_model" name="SPRING Model" license="MIT" version="@TOOL_VERSION@+galaxy@VERSION_SUFFIX@" profile="20.01"> <description>complex structures</description> <macros> <import>macros.xml</import> </macros> <expand macro="requirements" /> <command detect_errors="exit_code"><![CDATA[ spring_model.py -a '$first_target' -b '$second_target' @pdb_source@ -c '$cross' -o '$output' ]]> </command> <inputs> <param name="first_target" format="hhr" type="data" label="First HHR target file" help="Threading result for target sequence using HHsearch." /> <param name="second_target" format="hhr" type="data" label="Second HHR target file" help="Threading result for target sequence using HHsearch." /> <param name="cross" format="tabular" type="data" label="Cross Reference" help="SPRING PDB Cross Reference as produced by SPRING Cross tool." /> <expand macro="pdb_source" /> </inputs> <outputs> <data format="pdb" name="output" label="SPRING Model Structure" /> </outputs> <tests> <test> <param name="first_target" value="model/ACE2_HUMAN.hhr" ftype="hhr" /> <param name="second_target" value="model/SPIKE_SARS2.hhr" ftype="hhr" /> <conditional name="pdb_source"> <param name="pdb_source_selector" value="history" /> <param name="ffindex" value="model/pdb.ffindex" /> <param name="ffdata" value="model/pdb.ffdata" /> </conditional> <param name="cross" value="model/crossreference.txt" /> <output name="output" file="model/sp|Q9BYF1|ACE2_HUMAN.sp|P0DTC2|SPIKE_SARS2.pdb" /> </test> <test> <param name="first_target" value="model/ACE2_HUMAN.hhr" ftype="hhr" /> <param name="second_target" value="model/SPIKE_SARS2.hhr" ftype="hhr" /> <conditional name="pdb_source"> <param name="pdb_source_selector" value="indexed" /> <param name="pdb" value="pdb01_model" /> </conditional> <param name="cross" value="model/crossreference.txt" /> <output name="output" file="model/sp|Q9BYF1|ACE2_HUMAN.sp|P0DTC2|SPIKE_SARS2.pdb" /> </test> <test> <param name="first_target" value="model/ACE2_HUMAN.hhr" ftype="hhr" /> <param name="second_target" value="model/SPIKE_SARS2.hhr" ftype="hhr" /> <conditional name="pdb_source"> <param name="pdb_source_selector" value="indexed" /> <param name="pdb" value="pdb02_model" /> <param name="zipped" value="gz" /> </conditional> <param name="cross" value="model/crossreference.txt" /> <output name="output" file="model/sp|Q9BYF1|ACE2_HUMAN.sp|P0DTC2|SPIKE_SARS2_1.pdb" /> </test> </tests> <help><![CDATA[ **What it does** Creates protein complex model from HHsearch threading results. ]]> </help> <expand macro="citations" /> </tool>