On Fri, Nov 09, 2012 at 11:34:18AM +0100, Egon Willighagen wrote: > The ConnectivityTool can be used to split disconnected structures into > a list of "molecules". > > Because some discussion in the bug tracker came up around this too, > let's set some definitions. > A 'molecule' is a chemical graph, where each atom can be reached from > another atom via one or more bonds. > A salt is a disconnected structure, consisting of two or more 'molecules'.
You would then have to add that the above defined molecule has nothing to do with CDK's Molecule class which is, fortunately for your definition, phased out. ------------------------------------------------------------------------------ Monitor your physical, virtual and cloud infrastructure from a single web console. Get in-depth insight into apps, servers, databases, vmware, SAP, cloud infrastructure, etc. Download 30-day Free Trial. Pricing starts from $795 for 25 servers or applications! http://p.sf.net/sfu/zoho_dev2dev_nov _______________________________________________ Cdk-user mailing list [email protected] https://lists.sourceforge.net/lists/listinfo/cdk-user
