Statements (34)
| Predicate | Object |
|---|---|
| gptkbp:instanceOf |
gptkb:software
|
| gptkbp:developer |
Open Babel Project
|
| gptkbp:firstReleased |
2001
|
| gptkbp:function |
energy minimization
molecular modeling substructure searching 3D coordinate generation structure generation convert chemical file formats descriptor calculation |
| gptkbp:genre |
cheminformatics software
|
| https://www.w3.org/2000/01/rdf-schema#label |
Open Babel
|
| gptkbp:latestReleaseVersion |
2021-03-01
3.1.1 |
| gptkbp:license |
gptkb:GNU_General_Public_License
|
| gptkbp:operatingSystem |
gptkb:Windows
gptkb:macOS gptkb:Linux |
| gptkbp:programmingLanguage |
gptkb:C++
|
| gptkbp:repository |
https://github.com/openbabel/openbabel
|
| gptkbp:supportsFormat |
gptkb:PDB
gptkb:SDF gptkb:CML gptkb:InChI XYZ SMILES |
| gptkbp:usedIn |
computational chemistry
bioinformatics drug discovery chemical informatics |
| gptkbp:website |
https://openbabel.org/
|
| gptkbp:bfsParent |
gptkb:SMARTS
gptkb:Chemical_Markup_Language |
| gptkbp:bfsLayer |
7
|