Scaffold Generator: a Java library implementing molecular scaffold functionalities in the Chemistry Development Kit (CDK)

Table 3 Numbers of resulting scaffolds in scaffold network and scaffold forest constructed from COCONUT and DrugBank

	COCONUT	DrugBank
Number of molecules after filtering (< 11 rings)	395,450	11,127
Number of scaffold network scaffolds	392,888	23,765
Number of scaffold trees	6200	766
Number of scaffold tree scaffolds	173,526	10,716

ISSN: 1758-2946