[Cdk-user] jchempainteidtorpanel

Hello,

I used JChemPaintEidtorPanel like following and got error messages. Could you help me figure out what might be wrong?

import javax.swing.*;

import org.openscience.cdk.applications.jchempaint.*;

import java.awt.Dimension;

import java.awt.event.*;

import java.awt.BorderLayout;

import org.openscience.cdk.smiles.SmilesParser;

import org.openscience.cdk.Molecule;

import org.openscience.cdk.ChemModel;

import org.openscience.cdk.SetOfAtomContainers;

import org.openscience.cdk.SetOfMolecules;

import org.openscience.cdk.exception.*;

public class MolSketch

{

public static void main(String[] ags)

{

MolSketch ms = new MolSketch();

}

public MolSketch()

{

SmilesParser parser = new SmilesParser() ;

try{

Molecule mol= parser.parseSmiles("c1ccccc1");

SetOfMolecules set = new SetOfMolecules();

set.addMolecule(mol);

ChemModel chem = new ChemModel();

chem.setSetOfMolecules(set);

model = new JChemPaintModel(chem) ;

}

catch(InvalidSmilesException ise)

{

System.out.println("smiles");

}

JFrame frame = JChemPaintEditorPanel.getNewFrame(model);

frame.pack();

frame.setVisible(true);

}

The running result is it brings up greyout frame and bunch of errors messages in the console window. (You will see it after you run this program);

Your help is highly appreciated.

Thanks.

Hongmei

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