Open Babel Documentation ReleaseGeoffrey R Hutchison Chris Morley Craig James

Source URL: openbabel.org

Banck Journal of Cheminformatics 2012, 4(Suppl 1):F4 http://www.jcheminf.com/content/4/S1/F4 ORAL PRESENTATION Open Access

Source URL: www.jcheminf.com

• OpenBabel
• Debian
• Chemistry Development Kit
• Alioth
• Deb
• Software
• Science
• Cheminformatics

Openness as infrastructure

Source URL: www.biomedcentral.com

• Ruby
• OpenBabel
• Python
• SWIG
• Cheminformatics
• Application programming interface
• Object-oriented programming
• Cross-platform
• JavaScript
• Computing
• Software
• Scripting languages

Efficient SIMULTANEOUS matching of multiple SMARTs using the chemaxon toolkits Roger Sayle Nextmove software ltd Cambridge uk

Source URL: www.chemaxon.com

• Chemical database
• Simplified molecular-input line-entry specification
• Subgraph isomorphism problem
• OpenBabel
• Isotope
• Pattern matching
• ChemAxon
• Fingerprint
• Chemical substance
• Chemistry
• Cheminformatics
• Science