Difference between revisions of "Category:Capabilities"

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* '''[[:Category:Developer|Complete programmer's toolkit]]''' including C++, [[Perl]], [[Python]] interfaces for easy custom software development
 
* '''[[:Category:Developer|Complete programmer's toolkit]]''' including C++, [[Perl]], [[Python]] interfaces for easy custom software development
 
* Support for a huge variety of '''common chemical file formats''', including [[MDL Molfile | SDF/MOL]], [[Sybyl mol2]], [[PDB]], [[SMILES]], [[XYZ (format) | XYZ]], [[CML]]... ([[:Category:Formats|details]])
 
* Support for a huge variety of '''common chemical file formats''', including [[MDL Molfile | SDF/MOL]], [[Sybyl mol2]], [[PDB]], [[SMILES]], [[XYZ (format) | XYZ]], [[CML]]... ([[:Category:Formats|details]])
* '''Automatic recognition of file type'' based on [[List of extensions|filename extension]]
+
* '''Automatic recognition of file type''' based on [[List of extensions|filename extension]]
 
* Implementation of Daylight '''[[SMARTS]]''' molecular matching syntax
 
* Implementation of Daylight '''[[SMARTS]]''' molecular matching syntax
 
* [[Gasteiger-Marsili]] partial charge calculation
 
* [[Gasteiger-Marsili]] partial charge calculation

Revision as of 17:46, 19 October 2006

Open Babel is a chemical toolbox designed to speak the many languages of chemical data. It's an open, collaborative project allowing anyone to search, convert, analyze, or store data from molecular modeling, chemistry, solid-state materials, biochemistry, or related areas.

Among other features, Open Babel offers:

Subcategories

This category has only the following subcategory.

Pages in category "Capabilities"

The following 2 pages are in this category, out of 2 total.