/*
* Jalview - A Sequence Alignment Editor and Viewer (Version 2.7)
* Copyright (C) 2011 J Procter, AM Waterhouse, J Engelhardt, LM Lui, G Barton, M Clamp, S Searle
*
* This file is part of Jalview.
*
* Jalview is free software: you can redistribute it and/or
* modify it under the terms of the GNU General Public License
* as published by the Free Software Foundation, either version 3 of the License, or (at your option) any later version.
*
* Jalview is distributed in the hope that it will be useful, but
* WITHOUT ANY WARRANTY; without even the implied warranty
* of MERCHANTABILITY or FITNESS FOR A PARTICULAR
* PURPOSE. See the GNU General Public License for more details.
*
* You should have received a copy of the GNU General Public License along with Jalview. If not, see .
*/
package MCview;
import java.io.*;
import java.awt.event.*;
import javax.swing.*;
import jalview.datamodel.*;
import jalview.gui.*;
import jalview.io.*;
import jalview.schemes.*;
import jalview.ws.ebi.EBIFetchClient;
import java.awt.BorderLayout;
public class PDBViewer extends JInternalFrame implements Runnable
{
/**
* The associated sequence in an alignment
*/
PDBCanvas pdbcanvas;
PDBEntry pdbentry;
SequenceI[] seq;
String[] chains;
AlignmentPanel ap;
String protocol;
String tmpPDBFile;
public PDBViewer(PDBEntry pdbentry, SequenceI[] seq, String[] chains,
AlignmentPanel ap, String protocol)
{
this.pdbentry = pdbentry;
this.seq = seq;
this.chains = chains;
this.ap = ap;
this.protocol = protocol;
try
{
jbInit();
} catch (Exception ex)
{
ex.printStackTrace();
}
StringBuffer title = new StringBuffer(seq[0].getName() + ":"
+ pdbentry.getFile());
pdbcanvas = new PDBCanvas();
setContentPane(pdbcanvas);
if (pdbentry.getFile() != null)
{
try
{
tmpPDBFile = pdbentry.getFile();
PDBfile pdbfile = new PDBfile(tmpPDBFile,
jalview.io.AppletFormatAdapter.FILE);
pdbcanvas.init(pdbentry, seq, chains, ap, protocol);
} catch (java.io.IOException ex)
{
ex.printStackTrace();
}
}
else
{
Thread worker = new Thread(this);
worker.start();
}
if (pdbentry.getProperty() != null)
{
if (pdbentry.getProperty().get("method") != null)
{
title.append(" Method: ");
title.append(pdbentry.getProperty().get("method"));
}
if (pdbentry.getProperty().get("chains") != null)
{
title.append(" Chain:");
title.append(pdbentry.getProperty().get("chains"));
}
}
Desktop.addInternalFrame(this, title.toString(), 400, 400);
}
public void run()
{
try
{
EBIFetchClient ebi = new EBIFetchClient();
String query = "pdb:" + pdbentry.getId();
pdbentry.setFile(ebi.fetchDataAsFile(query, "default", "raw")
.getAbsolutePath());
if (pdbentry.getFile() != null)
pdbcanvas.init(pdbentry, seq, chains, ap, protocol);
} catch (Exception ex)
{
pdbcanvas.errorMessage = "Error retrieving file: " + pdbentry.getId();
ex.printStackTrace();
}
}
private void jbInit() throws Exception
{
this.addKeyListener(new KeyAdapter()
{
public void keyPressed(KeyEvent evt)
{
pdbcanvas.keyPressed(evt);
}
});
this.setJMenuBar(jMenuBar1);
fileMenu.setText("File");
coloursMenu.setText("Colours");
saveMenu.setActionCommand("Save Image");
saveMenu.setText("Save As");
png.setText("PNG");
png.addActionListener(new ActionListener()
{
public void actionPerformed(ActionEvent e)
{
png_actionPerformed(e);
}
});
eps.setText("EPS");
eps.addActionListener(new ActionListener()
{
public void actionPerformed(ActionEvent e)
{
eps_actionPerformed(e);
}
});
mapping.setText("View Mapping");
mapping.addActionListener(new ActionListener()
{
public void actionPerformed(ActionEvent e)
{
mapping_actionPerformed(e);
}
});
wire.setText("Wireframe");
wire.addActionListener(new ActionListener()
{
public void actionPerformed(ActionEvent e)
{
wire_actionPerformed(e);
}
});
depth.setSelected(true);
depth.setText("Depthcue");
depth.addActionListener(new ActionListener()
{
public void actionPerformed(ActionEvent e)
{
depth_actionPerformed(e);
}
});
zbuffer.setSelected(true);
zbuffer.setText("Z Buffering");
zbuffer.addActionListener(new ActionListener()
{
public void actionPerformed(ActionEvent e)
{
zbuffer_actionPerformed(e);
}
});
charge.setText("Charge & Cysteine");
charge.addActionListener(new ActionListener()
{
public void actionPerformed(ActionEvent e)
{
charge_actionPerformed(e);
}
});
chain.setText("By Chain");
chain.addActionListener(new ActionListener()
{
public void actionPerformed(ActionEvent e)
{
chain_actionPerformed(e);
}
});
seqButton.setSelected(true);
seqButton.setText("By Sequence");
seqButton.addActionListener(new ActionListener()
{
public void actionPerformed(ActionEvent e)
{
seqButton_actionPerformed(e);
}
});
allchains.setSelected(true);
allchains.setText("Show All Chains");
allchains.addItemListener(new ItemListener()
{
public void itemStateChanged(ItemEvent e)
{
allchains_itemStateChanged(e);
}
});
zappo.setText("Zappo");
zappo.addActionListener(new ActionListener()
{
public void actionPerformed(ActionEvent e)
{
zappo_actionPerformed(e);
}
});
taylor.setText("Taylor");
taylor.addActionListener(new ActionListener()
{
public void actionPerformed(ActionEvent e)
{
taylor_actionPerformed(e);
}
});
hydro.setText("Hydro");
hydro.addActionListener(new ActionListener()
{
public void actionPerformed(ActionEvent e)
{
hydro_actionPerformed(e);
}
});
helix.setText("Helix");
helix.addActionListener(new ActionListener()
{
public void actionPerformed(ActionEvent e)
{
helix_actionPerformed(e);
}
});
strand.setText("Strand");
strand.addActionListener(new ActionListener()
{
public void actionPerformed(ActionEvent e)
{
strand_actionPerformed(e);
}
});
turn.setText("Turn");
turn.addActionListener(new ActionListener()
{
public void actionPerformed(ActionEvent e)
{
turn_actionPerformed(e);
}
});
buried.setText("Buried");
buried.addActionListener(new ActionListener()
{
public void actionPerformed(ActionEvent e)
{
buried_actionPerformed(e);
}
});
user.setText("User Defined...");
user.addActionListener(new ActionListener()
{
public void actionPerformed(ActionEvent e)
{
user_actionPerformed(e);
}
});
viewMenu.setText("View");
background.setText("Background Colour...");
background.addActionListener(new ActionListener()
{
public void actionPerformed(ActionEvent e)
{
background_actionPerformed(e);
}
});
savePDB.setText("PDB File");
savePDB.addActionListener(new ActionListener()
{
public void actionPerformed(ActionEvent e)
{
savePDB_actionPerformed(e);
}
});
jMenuBar1.add(fileMenu);
jMenuBar1.add(coloursMenu);
jMenuBar1.add(viewMenu);
fileMenu.add(saveMenu);
fileMenu.add(mapping);
saveMenu.add(savePDB);
saveMenu.add(png);
saveMenu.add(eps);
coloursMenu.add(seqButton);
coloursMenu.add(chain);
coloursMenu.add(charge);
coloursMenu.add(zappo);
coloursMenu.add(taylor);
coloursMenu.add(hydro);
coloursMenu.add(helix);
coloursMenu.add(strand);
coloursMenu.add(turn);
coloursMenu.add(buried);
coloursMenu.add(user);
coloursMenu.add(background);
ButtonGroup bg = new ButtonGroup();
bg.add(seqButton);
bg.add(chain);
bg.add(charge);
bg.add(zappo);
bg.add(taylor);
bg.add(hydro);
bg.add(helix);
bg.add(strand);
bg.add(turn);
bg.add(buried);
bg.add(user);
if (jalview.gui.UserDefinedColours.getUserColourSchemes() != null)
{
java.util.Enumeration userColours = jalview.gui.UserDefinedColours
.getUserColourSchemes().keys();
while (userColours.hasMoreElements())
{
final JRadioButtonMenuItem radioItem = new JRadioButtonMenuItem(
userColours.nextElement().toString());
radioItem.setName("USER_DEFINED");
radioItem.addMouseListener(new MouseAdapter()
{
public void mousePressed(MouseEvent evt)
{
if (evt.isControlDown()
|| SwingUtilities.isRightMouseButton(evt))
{
radioItem.removeActionListener(radioItem.getActionListeners()[0]);
int option = JOptionPane.showInternalConfirmDialog(
jalview.gui.Desktop.desktop,
"Remove from default list?",
"Remove user defined colour",
JOptionPane.YES_NO_OPTION);
if (option == JOptionPane.YES_OPTION)
{
jalview.gui.UserDefinedColours
.removeColourFromDefaults(radioItem.getText());
coloursMenu.remove(radioItem);
}
else
{
radioItem.addActionListener(new ActionListener()
{
public void actionPerformed(ActionEvent evt)
{
user_actionPerformed(evt);
}
});
}
}
}
});
radioItem.addActionListener(new ActionListener()
{
public void actionPerformed(ActionEvent evt)
{
user_actionPerformed(evt);
}
});
coloursMenu.add(radioItem);
bg.add(radioItem);
}
}
viewMenu.add(wire);
viewMenu.add(depth);
viewMenu.add(zbuffer);
viewMenu.add(allchains);
}
JMenuBar jMenuBar1 = new JMenuBar();
JMenu fileMenu = new JMenu();
JMenu coloursMenu = new JMenu();
JMenu saveMenu = new JMenu();
JMenuItem png = new JMenuItem();
JMenuItem eps = new JMenuItem();
JMenuItem mapping = new JMenuItem();
JCheckBoxMenuItem wire = new JCheckBoxMenuItem();
JCheckBoxMenuItem depth = new JCheckBoxMenuItem();
JCheckBoxMenuItem zbuffer = new JCheckBoxMenuItem();
JCheckBoxMenuItem allchains = new JCheckBoxMenuItem();
JRadioButtonMenuItem charge = new JRadioButtonMenuItem();
JRadioButtonMenuItem chain = new JRadioButtonMenuItem();
JRadioButtonMenuItem seqButton = new JRadioButtonMenuItem();
JRadioButtonMenuItem hydro = new JRadioButtonMenuItem();
JRadioButtonMenuItem taylor = new JRadioButtonMenuItem();
JRadioButtonMenuItem zappo = new JRadioButtonMenuItem();
JRadioButtonMenuItem user = new JRadioButtonMenuItem();
JRadioButtonMenuItem buried = new JRadioButtonMenuItem();
JRadioButtonMenuItem turn = new JRadioButtonMenuItem();
JRadioButtonMenuItem strand = new JRadioButtonMenuItem();
JRadioButtonMenuItem helix = new JRadioButtonMenuItem();
JMenu viewMenu = new JMenu();
JMenuItem background = new JMenuItem();
JMenuItem savePDB = new JMenuItem();
/**
* DOCUMENT ME!
*
* @param e
* DOCUMENT ME!
*/
public void eps_actionPerformed(ActionEvent e)
{
makePDBImage(jalview.util.ImageMaker.EPS);
}
/**
* DOCUMENT ME!
*
* @param e
* DOCUMENT ME!
*/
public void png_actionPerformed(ActionEvent e)
{
makePDBImage(jalview.util.ImageMaker.PNG);
}
void makePDBImage(int type)
{
int width = pdbcanvas.getWidth();
int height = pdbcanvas.getHeight();
jalview.util.ImageMaker im;
if (type == jalview.util.ImageMaker.PNG)
{
im = new jalview.util.ImageMaker(this, jalview.util.ImageMaker.PNG,
"Make PNG image from view", width, height, null, null);
}
else
{
im = new jalview.util.ImageMaker(this, jalview.util.ImageMaker.EPS,
"Make EPS file from view", width, height, null,
this.getTitle());
}
if (im.getGraphics() != null)
{
pdbcanvas.drawAll(im.getGraphics(), width, height);
im.writeImage();
}
}
public void charge_actionPerformed(ActionEvent e)
{
pdbcanvas.bysequence = false;
pdbcanvas.pdb.setChargeColours();
pdbcanvas.redrawneeded = true;
pdbcanvas.repaint();
}
public void hydro_actionPerformed(ActionEvent e)
{
pdbcanvas.bysequence = false;
pdbcanvas.pdb.setColours(new HydrophobicColourScheme());
pdbcanvas.redrawneeded = true;
pdbcanvas.repaint();
}
public void chain_actionPerformed(ActionEvent e)
{
pdbcanvas.bysequence = false;
pdbcanvas.pdb.setChainColours();
pdbcanvas.redrawneeded = true;
pdbcanvas.repaint();
}
public void zbuffer_actionPerformed(ActionEvent e)
{
pdbcanvas.zbuffer = !pdbcanvas.zbuffer;
pdbcanvas.redrawneeded = true;
pdbcanvas.repaint();
}
public void molecule_actionPerformed(ActionEvent e)
{
pdbcanvas.bymolecule = !pdbcanvas.bymolecule;
pdbcanvas.redrawneeded = true;
pdbcanvas.repaint();
}
public void depth_actionPerformed(ActionEvent e)
{
pdbcanvas.depthcue = !pdbcanvas.depthcue;
pdbcanvas.redrawneeded = true;
pdbcanvas.repaint();
}
public void wire_actionPerformed(ActionEvent e)
{
pdbcanvas.wire = !pdbcanvas.wire;
pdbcanvas.redrawneeded = true;
pdbcanvas.repaint();
}
public void seqButton_actionPerformed(ActionEvent e)
{
pdbcanvas.bysequence = true;
pdbcanvas.updateSeqColours();
}
public void mapping_actionPerformed(ActionEvent e)
{
jalview.gui.CutAndPasteTransfer cap = new jalview.gui.CutAndPasteTransfer();
try
{
cap.setText(pdbcanvas.mappingDetails.toString());
Desktop.addInternalFrame(cap, "PDB - Sequence Mapping", 550, 600);
} catch (OutOfMemoryError oom)
{
new OOMWarning("Opening sequence to structure mapping report", oom);
cap.dispose();
}
}
public void allchains_itemStateChanged(ItemEvent e)
{
pdbcanvas.setAllchainsVisible(allchains.getState());
}
public void zappo_actionPerformed(ActionEvent e)
{
pdbcanvas.bysequence = false;
pdbcanvas.pdb.setColours(new ZappoColourScheme());
pdbcanvas.redrawneeded = true;
pdbcanvas.repaint();
}
public void taylor_actionPerformed(ActionEvent e)
{
pdbcanvas.bysequence = false;
pdbcanvas.pdb.setColours(new TaylorColourScheme());
pdbcanvas.redrawneeded = true;
pdbcanvas.repaint();
}
public void helix_actionPerformed(ActionEvent e)
{
pdbcanvas.bysequence = false;
pdbcanvas.pdb.setColours(new HelixColourScheme());
pdbcanvas.redrawneeded = true;
pdbcanvas.repaint();
}
public void strand_actionPerformed(ActionEvent e)
{
pdbcanvas.bysequence = false;
pdbcanvas.pdb.setColours(new StrandColourScheme());
pdbcanvas.redrawneeded = true;
pdbcanvas.repaint();
}
public void turn_actionPerformed(ActionEvent e)
{
pdbcanvas.bysequence = false;
pdbcanvas.pdb.setColours(new TurnColourScheme());
pdbcanvas.redrawneeded = true;
pdbcanvas.repaint();
}
public void buried_actionPerformed(ActionEvent e)
{
pdbcanvas.bysequence = false;
pdbcanvas.pdb.setColours(new BuriedColourScheme());
pdbcanvas.redrawneeded = true;
pdbcanvas.repaint();
}
public void user_actionPerformed(ActionEvent e)
{
if (e.getActionCommand().equals("User Defined..."))
{
// new UserDefinedColours(pdbcanvas, null);
}
else
{
UserColourScheme udc = (UserColourScheme) UserDefinedColours
.getUserColourSchemes().get(e.getActionCommand());
pdbcanvas.pdb.setColours(udc);
pdbcanvas.redrawneeded = true;
pdbcanvas.repaint();
}
}
public void background_actionPerformed(ActionEvent e)
{
java.awt.Color col = JColorChooser.showDialog(this,
"Select Background Colour", pdbcanvas.backgroundColour);
if (col != null)
{
pdbcanvas.backgroundColour = col;
pdbcanvas.redrawneeded = true;
pdbcanvas.repaint();
}
}
public void savePDB_actionPerformed(ActionEvent e)
{
JalviewFileChooser chooser = new JalviewFileChooser(
jalview.bin.Cache.getProperty("LAST_DIRECTORY"));
chooser.setFileView(new JalviewFileView());
chooser.setDialogTitle("Save PDB File");
chooser.setToolTipText("Save");
int value = chooser.showSaveDialog(this);
if (value == JalviewFileChooser.APPROVE_OPTION)
{
try
{
BufferedReader in = new BufferedReader(new FileReader(tmpPDBFile));
File outFile = chooser.getSelectedFile();
PrintWriter out = new PrintWriter(new FileOutputStream(outFile));
String data;
while ((data = in.readLine()) != null)
{
if (!(data.indexOf("
") > -1 || data.indexOf("
") > -1))
{
out.println(data);
}
}
out.close();
} catch (Exception ex)
{
ex.printStackTrace();
}
}
}
}