Mercurial > repos > chemteam > gmx_makendx

diff makendx.xml @ 6:d9eb276dfa32 draft

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"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/tools/gromacs commit 7a25958195ccc8f448dd64ddcc36e8f5e5979d8b"
author chemteam
date Wed, 20 May 2020 12:59:41 -0400
parents 48dcca6f45ce
children
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--- a/makendx.xml	Fri May 08 07:37:22 2020 -0400
+++ b/makendx.xml	Wed May 20 12:59:41 2020 -0400
@@ -1,7 +1,8 @@
-<tool id="gmx_makendx" name="Create GROMACS index files" version="@VERSION@">
+<tool id="gmx_makendx" name="Create GROMACS index files" version="@TOOL_VERSION@+galaxy@GALAXY_VERSION@">
     <description>using make_ndx</description>
     <macros>
         <import>macros.xml</import>
+        <token name="@GALAXY_VERSION@">0</token>
     </macros>
 
     <expand macro="requirements" />
@@ -35,12 +36,12 @@
     </outputs>
     <tests>
         <test>
-            <param name="input_file" value="md_0_1.gro" ftype="gro"/>
-            <param name="sel" value="! 1 &amp; 14" />
-            <output name="ndx" file="md_0_1.ndx">
+            <param name="input_file" value="str_ions.gro" ftype="gro"/>
+            <param name="sel" value="! 1 &amp; 13" />
+            <output name="ndx">
                 <assert_contents>
-                    <has_line line="[ !Protein_&amp;_non-Water ]"/>
-                    <has_text text="38369 38370 38371 38372 38373 38374 38375 38376"/>
+                    <has_line line="[ !Protein_&amp;_CL ]"/>
+                    <has_text text="  93   94"/>
                 </assert_contents>
             </output>
         </test>