| Miscellaneous |
| Version lineage of this tool (guids ordered most recent to oldest) |
| toolshed.g2.bx.psu.edu/repos/bgruening/ctb_rdkit_descriptors/ctb_rdkit_descriptors/2020.03.4+galaxy0 |
| toolshed.g2.bx.psu.edu/repos/bgruening/ctb_rdkit_descriptors/ctb_rdkit_descriptors/0.6 (this tool) |
| toolshed.g2.bx.psu.edu/repos/bgruening/ctb_rdkit_descriptors/ctb_rdkit_descriptors/0.5 |
| toolshed.g2.bx.psu.edu/repos/bgruening/ctb_rdkit_descriptors/ctb_rdkit_descriptors/0.4 |
| ctb_rdkit_descriptors |
| Requirements (dependencies defined in the <requirements> tag set) |
| name | version | type |
| rdkit | 2019.03.1 | package |
| Functional tests |
| name | inputs | outputs | required files |
| Test-1 |
header: True infile: CID_3037.sdf |
attributes: name |
CID_3037.sdf name |