minor demo updates

This commit is contained in:
Greg Landrum
2008-01-31 06:54:42 +00:00
parent 28fb123dcd
commit dfbac1fd13
4 changed files with 12 additions and 2 deletions

View File

@@ -25,6 +25,5 @@ public class main {
System.out.println("hss: " + RDKFuncs.HasSubstructMatch(mol,RDKFuncs.MolFromSmarts("C")));
RingInfo rI= mol.getRingInfo();
System.out.println("ri: " + rI.isAtomInRingOfSize(0,6) + " " + rI.isAtomInRingOfSize(0,5) );
}
}