Mercurial > repos > bgruening > openbabel_genprop
comparison macros.xml @ 13:417845394cdf draft
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/openbabel commit 1fe240ef0064a1a4a66d9be1ccace53824280b75"
| author | bgruening |
|---|---|
| date | Mon, 19 Oct 2020 14:46:54 +0000 |
| parents | a72ae2711a97 |
| children | b249bf9be0d1 |
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| 12:a72ae2711a97 | 13:417845394cdf |
|---|---|
| 14 </xml> | 14 </xml> |
| 15 | 15 |
| 16 <xml name="infile_all_types"> | 16 <xml name="infile_all_types"> |
| 17 <param name="infile" format="sdf,mol,mol2,cml,inchi,smi,pdb" type="data" label="Molecular input file" | 17 <param name="infile" format="sdf,mol,mol2,cml,inchi,smi,pdb" type="data" label="Molecular input file" |
| 18 help="Valid file types are: SDF, MOL, MOL2, CML, InChI, SMILES, and PDB"/> | 18 help="Valid file types are: SDF, MOL, MOL2, CML, InChI, SMILES, and PDB"/> |
| 19 </xml> | |
| 20 | |
| 21 <xml name="infile_all_types_except_inchi"> | |
| 22 <param name="infile" format="sdf,mol,mol2,cml,smi,pdb" type="data" label="Molecular input file" | |
| 23 help="Valid file types are: SDF, MOL, MOL2, CML, SMILES, and PDB"/> | |
| 19 </xml> | 24 </xml> |
| 20 | 25 |
| 21 <xml name="2D_3D_opts"> | 26 <xml name="2D_3D_opts"> |
| 22 <param name="gen2d" type="boolean" truevalue="--gen2d" falsevalue="" checked="false" | 27 <param name="gen2d" type="boolean" truevalue="--gen2d" falsevalue="" checked="false" |
| 23 label="Generate 2D coordinates" help="(--gen2d)" /> | 28 label="Generate 2D coordinates" help="(--gen2d)" /> |