Automatic generation of 3D structures and conformers of...

Automatic generation of 3D structures and conformers of molecules in Marvin - Clean/3D

• The method in a nutshell
• Using Clean/3D menu from the MSketch/MView GUI
• Batch processing via MolConvert
• Runtime parameters, special tricks
• Examples

ChemAxon MarvinSketch and MarvinView implementation of Clean/3D: http://www.chemaxon.com/marvin/doc/dev/index.html#examples