Mercurial > repos > bgruening > openbabel_svg_depiction
comparison macros.xml @ 0:88f229c63734 draft
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/openbabel commit 01da22e4184a5a6f6a3dd4631a7b9c31d1b6d502
author | bgruening |
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date | Sat, 20 May 2017 08:38:05 -0400 |
parents | |
children | 4ad272a2e3ea |
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-1:000000000000 | 0:88f229c63734 |
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1 <macros> | |
2 <token name="@VERSION@">2.4.1</token> | |
3 | |
4 <xml name="requirements"> | |
5 <requirements> | |
6 <requirement type="package" version="2.4.1">openbabel</requirement> | |
7 <yield /> | |
8 </requirements> | |
9 </xml> | |
10 | |
11 <xml name="output_like_input"> | |
12 <data name="outfile" format_source="infile" /> | |
13 </xml> | |
14 | |
15 <xml name="infile_all_types"> | |
16 <param name="infile" format="sdf,mol,mol2,cml,inchi,smi" type="data" label="Molecular input file" | |
17 help="Valid file types are: SDF, MOL, MOL2, CML, InChI and SMILES"/> | |
18 </xml> | |
19 | |
20 <xml name="2D_3D_opts"> | |
21 <param name="gen2d" type="boolean" truevalue="--gen2d" falsevalue="" checked="false" | |
22 label="Generate 2D coordinates" help="(--gen2d)" /> | |
23 <param name="gen3d" type="boolean" truevalue="--gen3d" falsevalue="" checked="false" | |
24 label="Generate 3D coordinates" help="(--gen3d)" /> | |
25 </xml> | |
26 | |
27 <xml name="stdio"> | |
28 <stdio> | |
29 <exit_code range="1:" level="fatal" description="Error occurred. Please check Tool Standard Error" /> | |
30 </stdio> | |
31 </xml> | |
32 | |
33 <xml name="citations"> | |
34 <citations> | |
35 <citation type="doi">10.1186/1758-2946-3-33</citation> | |
36 <yield /> | |
37 </citations> | |
38 </xml> | |
39 </macros> | |
40 | |
41 | |
42 |