Pybel: a Python wrapper for the OpenBabel cheminformatics toolkit

Noel M O'Boyle¹^,2 , Chris Morley³ and Geoffrey R Hutchison⁴

¹Unilever Centre for Molecular Science Informatics, Department of Chemistry, University of Cambridge, Lensfield Road, Cambridge CB2 1EW, UK

²Cambridge Crystallographic Data Centre, 12 Union Road, Cambridge CB2 1EZ, UK

³OpenBabel Development Team

⁴Department of Chemistry, University of Pittsburgh, Chevron Science Center, 219 Parkman Avenue, Pittsburgh, PA 15260, USA

author email corresponding author email

Chemistry Central Journal 2008, 2:5doi:10.1186/1752-153X-2-5


Published:	9 March 2008

Additional file 1:

Pybel API. The HTML documentation of the Pybel API (application programming interface).

Format: ZIP Size: 4KB Download file