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package org.RDKit;
import static org.junit.Assert.*;
import java.io.File;
import org.junit.*;
/**
* JUnit tests for MolHash wrappers.
*/
public class MolHashTest extends GraphMolTest {
@Test
public void testMolHash1() {
ROMol m1;
m1 = RWMol.MolFromSmiles("C1CCCC(O)C1c1ccnc(OC)c1");
// we just test a few to make sure that the enum works
assertEquals("***1****(*2*****2*)*1", RDKFuncs.MolHash(new RWMol(m1),HashFunction.AnonymousGraph));
assertEquals("COc1cc(C2CCCCC2O)ccn1", RDKFuncs.MolHash(new RWMol(m1),HashFunction.CanonicalSmiles));
assertEquals("COC1CC(C2CCCCC2O)CCN1", RDKFuncs.MolHash(new RWMol(m1),HashFunction.ElementGraph));
}
public static void main(String args[]) {
org.junit.runner.JUnitCore.main("org.RDKit.MolHashTest");
}
}
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