Mercurial > repos > chemteam > gmx_setup

diff setup.xml @ 14:1d4dd4f908d4 draft

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"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/tree/master/tools/gromacs commit 2f3d14b4f200100881e362b0f3b97f0e8a36d1f3"
author chemteam
date Wed, 29 Sep 2021 07:42:14 +0000
parents 4da9ee404eab
children
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--- a/setup.xml	Mon Nov 23 10:46:34 2020 +0000
+++ b/setup.xml	Wed Sep 29 07:42:14 2021 +0000
@@ -50,9 +50,9 @@
 
     </inputs>
     <outputs>
-        <data name="output1" format="top" from_work_dir="topol.top"/>
-        <data name="output2" format="gro" from_work_dir="processed.gro"/>
-        <data name="output3" format="itp" from_work_dir="posres.itp"/>
+        <data name="output1" format="top" from_work_dir="topol.top" label="GROMACS setup (TOP) on ${on_string}"/>
+        <data name="output2" format="gro" from_work_dir="processed.gro" label="GROMACS setup (GRO) on ${on_string}"/>
+        <data name="output3" format="itp" from_work_dir="posres.itp" label="GROMACS setup (ITP) on ${on_string}"/>
         <expand macro="log_outputs" />
     </outputs>
     <tests>