| Miscellaneous |
| Version lineage of this tool (guids ordered most recent to oldest) |
| toolshed.g2.bx.psu.edu/repos/bgruening/openbabel_remions/openbabel_remIons/3.1.1+galaxy2 (this tool) |
| toolshed.g2.bx.psu.edu/repos/bgruening/openbabel_remions/openbabel_remIons/3.1.1+galaxy1 |
| toolshed.g2.bx.psu.edu/repos/bgruening/openbabel_remions/openbabel_remIons/3.1.1+galaxy0 |
| toolshed.g2.bx.psu.edu/repos/bgruening/openbabel_remions/openbabel_remIons/2.4.2.2.0 |
| toolshed.g2.bx.psu.edu/repos/bgruening/openbabel_remions/openbabel_remIons/2.4.2.1.0 |
| toolshed.g2.bx.psu.edu/repos/bgruening/openbabel_remions/openbabel_remIons/2.4.2.0 |
| toolshed.g2.bx.psu.edu/repos/bgruening/openbabel_remions/openbabel_remIons/2.4.1.0 |
| openbabel_remIons |
| Requirements (dependencies defined in the <requirements> tag set) |
| name | version | type |
| openbabel | 3.1.1 | package |
| python | 3.6 | package |
| Additional information about this tool |
python '$__tool_directory__/ob_remIons.py'
-i '${infile}'
-iformat '${infile.ext}'
-o '${outfile}'
$index
| Functional tests |
| name | inputs | outputs | required files |
| Test-1 |
infile: 2_mol.smi |
name: value |
2_mol.smi value |
| Test-2 |
infile: na-sal.inchi |
name: value |
na-sal.inchi value |
| Test-3 |
infile: multiple.inchi index: True |
name: value |
multiple.inchi value |