private void printDups(DuplicateHandler handler) {
Map<String, List<IAtomContainer>> map = handler.getDupMap();
int count = 0;
for (String key : map.keySet()) {
List<IAtomContainer> dups = map.get(key);
if (dups.size() == 1) {
System.out.println(count + "\t1\t" + AtomContainerPrinter.toString(dups.get(0)));
} else {
System.out.println(count + "\t" + dups.size());
}
count++;
}
}
private void run(String elementFormula, String fromString, Handler handler) {
AtomGenerator gen = new AtomGenerator(elementFormula, handler);
gen.run(AtomContainerPrinter.fromString(fromString, builder));
}