Commit c9c9a7d0 authored by Phuong Khanh Tran's avatar Phuong Khanh Tran
Browse files

Update MDB.java

parent eda72b90

src/MDB.java

+2 −2
Original line number Diff line number Diff line
@@ -94,14 +94,14 @@ public class MDB { 
        // Retrieve the partitioned array list based on the number of atoms

        int numAtoms = molecule.getNumAtoms();

        if (!db.containsKey(numAtoms)) {

            outputTextArea.append("No ArrayList with correct # of atoms" + "\n");

            outputTextArea.append("No ArrayList with correct # of atoms" + "\n\n");

            return null;

        }

        ArrayList<Molecule> moleculesWithSameNumAtoms = db.get(numAtoms);



        // Iterate through the array list of molecules with the same number of atoms

        for (Molecule dbMolecule : moleculesWithSameNumAtoms) {

            outputTextArea.append(dbMolecule.moleculeName + " vs " + molecule.moleculeName + "\n");

            outputTextArea.append(dbMolecule.moleculeName + " vs " + molecule.moleculeName + "\n\n");

            Molecule result = dbMolecule.areMoleculesEqual(molecule);

            if (result != null) {

                return result; // Return the isomorphic molecule