Mercurial > repos > chemteam > gmx_makendx
diff makendx.xml @ 6:7b530c213ec7 draft default tip
"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/tools/gromacs commit 7a25958195ccc8f448dd64ddcc36e8f5e5979d8b"
author | chemteam |
---|---|
date | Wed, 20 May 2020 16:50:52 +0000 |
parents | 64cab63793d5 |
children |
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--- a/makendx.xml Fri May 08 11:24:36 2020 +0000 +++ b/makendx.xml Wed May 20 16:50:52 2020 +0000 @@ -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 & 14" /> - <output name="ndx" file="md_0_1.ndx"> + <param name="input_file" value="str_ions.gro" ftype="gro"/> + <param name="sel" value="! 1 & 13" /> + <output name="ndx"> <assert_contents> - <has_line line="[ !Protein_&_non-Water ]"/> - <has_text text="38369 38370 38371 38372 38373 38374 38375 38376"/> + <has_line line="[ !Protein_&_CL ]"/> + <has_text text=" 93 94"/> </assert_contents> </output> </test>