Mercurial > repos > bgruening > openbabel_addh
comparison ob_addh.xml @ 7:d2e6d682bcd0 draft
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/openbabel commit ed9b6859de648aa5f7cde483732f5df20aaff90e
| author | bgruening |
|---|---|
| date | Tue, 07 May 2019 13:37:26 -0400 |
| parents | ada6daa717d2 |
| children | 43167f164076 |
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| 6:bfb8555f0003 | 7:d2e6d682bcd0 |
|---|---|
| 15 --pH "${pH_value}" | 15 --pH "${pH_value}" |
| 16 ]]> | 16 ]]> |
| 17 </command> | 17 </command> |
| 18 <inputs> | 18 <inputs> |
| 19 <expand macro="infile_all_types"/> | 19 <expand macro="infile_all_types"/> |
| 20 <param name="polar" type="boolean" truevalue="--polar" falsevalue="" label="Add hydrogens to polar atoms only"/> | 20 <param name="polar" type="boolean" truevalue="--polar" falsevalue="" label="Add hydrogens to polar atoms only (i.e. not to carbon atoms)"/> |
| 21 <param name="pH_value" type="float" value="7.4" min="0" max="14" label="Specify pH value"/> | 21 <param name="pH_value" type="float" value="7.4" min="0" max="14" label="Specify pH value"/> |
| 22 </inputs> | 22 </inputs> |
| 23 <outputs> | 23 <outputs> |
| 24 <expand macro="output_like_input"/> | 24 <expand macro="output_like_input"/> |
| 25 </outputs> | 25 </outputs> |