| Molecule datatypes and converters. Including SDF, MOL, SMILES, InChI, MOL2 ...
Repository-Maintainer: Björn Grüning Repository-Development: https://github.com/bgruening/galaxytools/tree/master/orphan_tool_dependencies |
hg clone https://toolshed.g2.bx.psu.edu/repos/iuc/molecule_datatypes
| Repository package_eigen_3_1 revision baedf7f82cc3 owned by iuc (prior install required) |
| Repository package_cmake_3_2_3 revision 1aea698a1c63 owned by iuc (prior install required) |
| Name | Version | Type | |
|---|---|---|---|
| openbabel | 2.3.2 | package | |
| Name | Description | Version | Minimum Galaxy Version |
|---|---|---|---|
| 1.0.0 | any | ||
| 1.0.0 | any | ||
| 1.0.0 | any | ||
| 1.0.0 | any | ||
| 1.0.0 | any | ||
| 1.0.0 | any | ||
| 1.0.0 | any | ||
| 1.0.0 | any | ||
| 1.0.0 | any | ||
| 1.0.0 | any | ||
| 1.0.0 | any | ||
| 1.0.1 | any | ||
| 1.0.0 | any | ||
| 1.0.0 | any | ||
| 1.0.0 | any | ||
| 1.0.0 | any | ||
| 1.0.0 | any | ||
| 1.0.0 | any | ||
| 1.0.0 | any | ||
| 1.0.0 | any | ||
| 1.0.0 | any | ||
| 1.0.0 | any | ||
| 1.0.0 | any | ||
| 1.0.0 | any | ||
| 1.0.0 | any | ||
| 1.0.0 | any | ||
| 1.0.0 | any | ||
| 1.0.0 | any | ||
| extension | type | mimetype | subclass |
|---|---|---|---|
| smi | galaxy.datatypes.molecules:SMILES | ||
| sdf | galaxy.datatypes.molecules:SDF | ||
| inchi | galaxy.datatypes.molecules:InChI | ||
| mol | galaxy.datatypes.molecules:MOL | ||
| mol2 | galaxy.datatypes.molecules:MOL2 | ||
| cml | galaxy.datatypes.molecules:CML | ||
| fps | galaxy.datatypes.molecules:FPS | text/html | |
| obfs | galaxy.datatypes.molecules:OBFS | text/html | |
| phar | galaxy.datatypes.molecules:PHAR | ||
| pdb | galaxy.datatypes.molecules:PDB | ||