add a demo

Code/Demos/SWIG/java_example/RDKFuncs.cpp

@@ -0,0 +1,35 @@
+// $Id$
+//
+// Copyright (C) 2008 Greg Landrum
+// All Rights Reserved
+//
+
+#include <string>
+#include <GraphMol/RDKitBase.h>
+#include <GraphMol/SmilesParse/SmilesParse.h>
+#include <GraphMol/SmilesParse/SmilesWrite.h>
+#include <GraphMol/Substruct/SubstructMatch.h>
+
+#include "RDKFuncs.h"
+
+using namespace RDKit;
+ROMol *MolFromSmiles(std::string smi) {
+  return SmilesToMol(smi);
+};
+ROMol *MolFromSmarts(std::string sma) {
+  return SmartsToMol(sma);
+};
+std::string MolToSmiles(ROMol *mol,bool doIsomericSmiles,
+                        bool doKekule, int rootedAtAtom) {
+  return MolToSmiles(*mol,doIsomericSmiles,doKekule,rootedAtAtom);
+};
+bool HasSubstructMatch(ROMol &mol,ROMol &query,bool useChirality,
+                       bool registerQuery){
+  MatchVectType mv;
+  return SubstructMatch(mol,query,mv,true,useChirality,registerQuery);
+};
+
+
+
+
+