Mercurial > repos > chemteam > mdanalysis_dihedral

comparison macros.xml @ 7:aaa130695a2b draft

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"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit 1b23e024af45cc0999d9142d07de6897d4189ec2"
author chemteam
date Mon, 24 Aug 2020 16:09:24 -0400
parents d8178fe9aaff
children
comparison
equal deleted inserted replaced
6:0493024c3318 7:aaa130695a2b
1 <macros> 1 <macros>
2 <token name="@VERSION@">0.20</token> 2 <token name="@TOOL_VERSION@">1.0.0</token>
3 <xml name="requirements"> 3 <xml name="requirements">
4 <requirements> 4 <requirements>
5 <requirement type="package" version="0.20.1">mdanalysis</requirement> 5 <requirement type="package" version="@TOOL_VERSION@">mdanalysis</requirement>
6 <yield/> 6 <yield/>
7 </requirements> 7 </requirements>
8 </xml> 8 </xml>
9 <xml name="analysis_inputs"> 9 <xml name="analysis_inputs">
10 <param format="dcd,xtc" name="trajin" type="data" label="DCD/XTC trajectory input"/> 10 <param format="dcd,xtc" name="trajin" type="data" label="DCD/XTC trajectory input" />
11 <param format="pdb,gro" name="strin" type="data" label="PDB/GRO input"/> 11 <param format="pdb,gro" name="strin" type="data" label="PDB/GRO input" />
12 <yield/> 12 <yield/>
13 </xml> 13 </xml>
14 <xml name="sanitizer"> 14 <xml name="sanitizer">
15 <sanitizer invalid_char=""> 15 <sanitizer invalid_char="">
16 <valid initial="string.ascii_letters,string.digits"/> 16 <valid initial="string.ascii_letters,string.digits" />
17 </sanitizer> 17 </sanitizer>
18 <yield/> 18 <yield/>
19 </xml> 19 </xml>
20 <xml name="sanitizer_resids"> 20 <xml name="sanitizer_resids">
21 <sanitizer invalid_char=""> 21 <sanitizer invalid_char="">
22 <valid initial="string.digits"/> 22 <valid initial="string.digits" />
23 </sanitizer> 23 </sanitizer>
24 <yield/> 24 <yield/>
25 </xml> 25 </xml>
26 <xml name="tests_inputs"> 26 <xml name="tests_inputs">
27 <param name="trajin" value="test.dcd" ftype="dcd"/> 27 <param name="trajin" value="test.dcd" ftype="dcd" />
28 <param name="strin" value="test.pdb" ftype="pdb"/> 28 <param name="strin" value="test.pdb" ftype="pdb" />
29 <yield/> 29 <yield/>
30 </xml> 30 </xml>
31 <xml name="tests_inputs_gmx"> 31 <xml name="tests_inputs_gmx">
32 <param name="trajin" value="test.xtc" ftype="xtc"/> 32 <param name="trajin" value="test.xtc" ftype="xtc" />
33 <param name="strin" value="test.gro" ftype="gro"/> 33 <param name="strin" value="test.gro" ftype="gro" />
34 <yield/> 34 <yield/>
35 </xml> 35 </xml>
36 <xml name="citations"> 36 <xml name="citations">
37 <citations> 37 <citations>
38 <citation type="doi">10.1093/bioinformatics/btz107</citation> 38 <citation type="doi">10.1093/bioinformatics/btz107</citation>