class TestFminer {
public static void main(String[] args) {
System.loadLibrary("fminer");
Fminer MyFminer;
MyFminer = new Fminer();
MyFminer.AddCompound ("COC1=CC=C(C=C1)C2=NC(=C([NH]2)C3=CC=CC=C3)C4=CC=CC=C4", 1);
MyFminer.AddCompound ("O=C1NC(=S)NC(=O)C1C(=O)NC2=CC=CC=C2", 2);
// ... continue adding compounds
MyFminer.AddActivity((boolean) true, 1);
MyFminer.AddActivity((boolean) false, 2);
// ... continue adding activities (true for active, false for inactive)
System.out.println(MyFminer.GetNoCompounds() + " compounds");
// Toy example: special settings for mining all fragments
MyFminer.SetChisqSig(0); // use no significance constraint
MyFminer.SetRefineSingles(true); // refine structures with support 1
// gather results for every root node in vector instead of immediate output
MyFminer.SetConsoleOut(false);
for (int j = 0; j < (int) MyFminer.GetNoRootNodes(); j++)
{
SVector result = MyFminer.MineRoot(j);
for(int i = 0; i < result.size(); i++)
{
System.out.println(result.get(i));
}
}
MyFminer = null;
}
}
