/*
* Jalview - A Sequence Alignment Editor and Viewer ($$Version-Rel$$)
* Copyright (C) $$Year-Rel$$ The Jalview Authors
*
* 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 .
* The Jalview Authors are detailed in the 'AUTHORS' file.
*/
package jalview.gui;
import java.awt.event.ActionEvent;
import java.awt.event.ActionListener;
import java.awt.event.MouseAdapter;
import java.awt.event.MouseEvent;
import java.io.File;
import java.util.ArrayList;
import java.util.Collections;
import java.util.List;
import java.util.Map;
import javax.swing.JInternalFrame;
import javax.swing.JMenu;
import javax.swing.JMenuItem;
import javax.swing.event.InternalFrameAdapter;
import javax.swing.event.InternalFrameEvent;
import jalview.api.AlignmentViewPanel;
import jalview.api.FeatureRenderer;
import jalview.bin.Cache;
import jalview.datamodel.PDBEntry;
import jalview.datamodel.SequenceI;
import jalview.datamodel.StructureViewerModel;
import jalview.datamodel.StructureViewerModel.StructureData;
import jalview.ext.rbvi.chimera.JalviewChimeraBinding;
import jalview.gui.StructureViewer.ViewerType;
import jalview.io.DataSourceType;
import jalview.io.StructureFile;
import jalview.structures.models.AAStructureBindingModel;
import jalview.util.ImageMaker.TYPE;
import jalview.util.MessageManager;
import jalview.util.Platform;
/**
* GUI elements for handling an external chimera display
*
* @author jprocter
*
*/
public class ChimeraViewFrame extends StructureViewerBase
{
private JalviewChimeraBinding jmb;
/*
* Path to Chimera session file. This is set when an open Jalview/Chimera
* session is saved, or on restore from a Jalview project (if it holds the
* filename of any saved Chimera sessions).
*/
private String chimeraSessionFile = null;
private int myWidth = 500;
private int myHeight = 150;
/**
* Initialise menu options.
*/
@Override
protected void initMenus()
{
super.initMenus();
savemenu.setVisible(false); // not yet implemented
viewMenu.add(fitToWindow);
JMenuItem writeFeatures = new JMenuItem(
MessageManager.getString("label.create_viewer_attributes"));
writeFeatures.setToolTipText(MessageManager
.getString("label.create_viewer_attributes_tip"));
writeFeatures.addActionListener(new ActionListener()
{
@Override
public void actionPerformed(ActionEvent e)
{
sendFeaturesToChimera();
}
});
viewerActionMenu.add(writeFeatures);
final JMenu fetchAttributes = new JMenu(
MessageManager.getString("label.fetch_chimera_attributes"));
fetchAttributes.setToolTipText(
MessageManager.getString("label.fetch_chimera_attributes_tip"));
fetchAttributes.addMouseListener(new MouseAdapter()
{
@Override
public void mouseEntered(MouseEvent e)
{
buildAttributesMenu(fetchAttributes);
}
});
viewerActionMenu.add(fetchAttributes);
}
/**
* Query the structure viewer for its residue attribute names and add them as
* items off the attributes menu
*
* @param attributesMenu
*/
protected void buildAttributesMenu(JMenu attributesMenu)
{
List atts = jmb.getChimeraAttributes();
attributesMenu.removeAll();
Collections.sort(atts);
for (String attName : atts)
{
JMenuItem menuItem = new JMenuItem(attName);
menuItem.addActionListener(new ActionListener()
{
@Override
public void actionPerformed(ActionEvent e)
{
if (getBinding().copyStructureAttributesToFeatures(attName,
getAlignmentPanel()) > 0)
{
getAlignmentPanel().getFeatureRenderer().featuresAdded();
}
}
});
attributesMenu.add(menuItem);
}
}
/**
* Sends command(s) to the structure viewer to create residue attributes for
* visible Jalview features
*/
protected void sendFeaturesToChimera()
{
// todo pull up?
int count = jmb.sendFeaturesToViewer(getAlignmentPanel());
statusBar.setText(
MessageManager.formatMessage("label.attributes_set", count));
}
/**
* open a single PDB structure in a new Chimera view
*
* @param pdbentry
* @param seq
* @param chains
* @param ap
*/
public ChimeraViewFrame(PDBEntry pdbentry, SequenceI[] seq,
String[] chains, final AlignmentPanel ap)
{
this();
openNewChimera(ap, new PDBEntry[] { pdbentry },
new SequenceI[][]
{ seq });
}
/**
* Create a helper to manage progress bar display
*/
protected void createProgressBar()
{
if (getProgressIndicator() == null)
{
setProgressIndicator(new ProgressBar(statusPanel, statusBar));
}
}
private void openNewChimera(AlignmentPanel ap, PDBEntry[] pdbentrys,
SequenceI[][] seqs)
{
createProgressBar();
jmb = newBindingModel(ap, pdbentrys, seqs);
addAlignmentPanel(ap);
useAlignmentPanelForColourbyseq(ap);
if (pdbentrys.length > 1)
{
useAlignmentPanelForSuperposition(ap);
}
jmb.setColourBySequence(true);
setSize(myWidth, myHeight);
initMenus();
addingStructures = false;
worker = new Thread(this);
worker.start();
this.addInternalFrameListener(new InternalFrameAdapter()
{
@Override
public void internalFrameClosing(
InternalFrameEvent internalFrameEvent)
{
closeViewer(false);
}
});
}
protected JalviewChimeraBindingModel newBindingModel(AlignmentPanel ap,
PDBEntry[] pdbentrys, SequenceI[][] seqs)
{
return new JalviewChimeraBindingModel(this,
ap.getStructureSelectionManager(), pdbentrys, seqs, null);
}
/**
* Create a new viewer from saved session state data including Chimera session
* file
*
* @param chimeraSessionFile
* @param alignPanel
* @param pdbArray
* @param seqsArray
* @param colourByChimera
* @param colourBySequence
* @param newViewId
*/
public ChimeraViewFrame(StructureViewerModel viewerData,
AlignmentPanel alignPanel, String sessionFile, String vid)
{
this();
setViewId(vid);
this.chimeraSessionFile = sessionFile;
Map pdbData = viewerData.getFileData();
PDBEntry[] pdbArray = new PDBEntry[pdbData.size()];
SequenceI[][] seqsArray = new SequenceI[pdbData.size()][];
int i = 0;
for (StructureData data : pdbData.values())
{
PDBEntry pdbentry = new PDBEntry(data.getPdbId(), null,
PDBEntry.Type.PDB, data.getFilePath());
pdbArray[i] = pdbentry;
List sequencesForPdb = data.getSeqList();
seqsArray[i] = sequencesForPdb
.toArray(new SequenceI[sequencesForPdb.size()]);
i++;
}
openNewChimera(alignPanel, pdbArray, seqsArray);
if (viewerData.isColourByViewer())
{
jmb.setColourBySequence(false);
seqColour.setSelected(false);
viewerColour.setSelected(true);
}
else if (viewerData.isColourWithAlignPanel())
{
jmb.setColourBySequence(true);
seqColour.setSelected(true);
viewerColour.setSelected(false);
}
}
/**
* create a new viewer containing several structures, optionally superimposed
* using the given alignPanel.
*
* @param pe
* @param seqs
* @param ap
*/
public ChimeraViewFrame(PDBEntry[] pe, boolean alignAdded,
SequenceI[][] seqs,
AlignmentPanel ap)
{
this();
setAlignAddedStructures(alignAdded);
openNewChimera(ap, pe, seqs);
}
/**
* Default constructor
*/
public ChimeraViewFrame()
{
super();
/*
* closeViewer will decide whether or not to close this frame
* depending on whether user chooses to Cancel or not
*/
setDefaultCloseOperation(JInternalFrame.DO_NOTHING_ON_CLOSE);
}
/**
* Launch Chimera. If we have a chimera session file name, send Chimera the
* command to open its saved session file.
*/
void initChimera()
{
jmb.setFinishedInit(false);
Desktop.addInternalFrame(this,
jmb.getViewerTitle(getViewerName(), true), getBounds().width,
getBounds().height);
if (!jmb.launchChimera())
{
JvOptionPane.showMessageDialog(Desktop.desktop,
MessageManager.formatMessage("label.open_viewer_failed",
getViewerName()),
MessageManager.getString("label.error_loading_file"),
JvOptionPane.ERROR_MESSAGE);
this.dispose();
return;
}
if (this.chimeraSessionFile != null)
{
boolean opened = jmb.openSession(chimeraSessionFile);
if (!opened)
{
System.err.println("An error occurred opening Chimera session file "
+ chimeraSessionFile);
}
}
jmb.startChimeraListener();
}
/**
* Open any newly added PDB structures in Chimera, having first fetched data
* from PDB (if not already saved).
*/
@Override
public void run()
{
_started = true;
// todo - record which pdbids were successfully imported.
StringBuilder errormsgs = new StringBuilder(128);
StringBuilder files = new StringBuilder(128);
List filePDB = new ArrayList<>();
List filePDBpos = new ArrayList<>();
PDBEntry thePdbEntry = null;
StructureFile pdb = null;
try
{
String[] curfiles = jmb.getStructureFiles(); // files currently in viewer
// TODO: replace with reference fetching/transfer code (validate PDBentry
// as a DBRef?)
for (int pi = 0; pi < jmb.getPdbCount(); pi++)
{
String file = null;
thePdbEntry = jmb.getPdbEntry(pi);
if (thePdbEntry.getFile() == null)
{
/*
* Retrieve PDB data, save to file, attach to PDBEntry
*/
file = fetchPdbFile(thePdbEntry);
if (file == null)
{
errormsgs.append("'" + thePdbEntry.getId() + "' ");
}
}
else
{
/*
* Got file already - ignore if already loaded in Chimera.
*/
file = new File(thePdbEntry.getFile()).getAbsoluteFile()
.getPath();
if (curfiles != null && curfiles.length > 0)
{
addingStructures = true; // already files loaded.
for (int c = 0; c < curfiles.length; c++)
{
if (curfiles[c].equals(file))
{
file = null;
break;
}
}
}
}
if (file != null)
{
filePDB.add(thePdbEntry);
filePDBpos.add(Integer.valueOf(pi));
files.append(" \"" + Platform.escapeBackslashes(file) + "\"");
}
}
} catch (OutOfMemoryError oomerror)
{
new OOMWarning("Retrieving PDB files: " + thePdbEntry.getId(),
oomerror);
} catch (Exception ex)
{
ex.printStackTrace();
errormsgs.append(
"When retrieving pdbfiles for '" + thePdbEntry.getId() + "'");
}
if (errormsgs.length() > 0)
{
JvOptionPane.showInternalMessageDialog(Desktop.desktop,
MessageManager.formatMessage(
"label.pdb_entries_couldnt_be_retrieved", new Object[]
{ errormsgs.toString() }),
MessageManager.getString("label.couldnt_load_file"),
JvOptionPane.ERROR_MESSAGE);
}
if (files.length() > 0)
{
jmb.setFinishedInit(false);
if (!addingStructures)
{
try
{
initChimera();
} catch (Exception ex)
{
Cache.log.error("Couldn't open Chimera viewer!", ex);
}
}
int num = -1;
for (PDBEntry pe : filePDB)
{
num++;
if (pe.getFile() != null)
{
try
{
int pos = filePDBpos.get(num).intValue();
long startTime = startProgressBar(getViewerName() + " "
+ MessageManager.getString("status.opening_file_for")
+ " " + pe.getId());
jmb.openFile(pe);
jmb.addSequence(pos, jmb.getSequence()[pos]);
File fl = new File(pe.getFile());
DataSourceType protocol = DataSourceType.URL;
try
{
if (fl.exists())
{
protocol = DataSourceType.FILE;
}
} catch (Throwable e)
{
} finally
{
stopProgressBar("", startTime);
}
// Explicitly map to the filename used by Chimera ;
pdb = jmb.getSsm().setMapping(jmb.getSequence()[pos],
jmb.getChains()[pos], pe.getFile(), protocol,
getProgressIndicator());
jmb.stashFoundChains(pdb, pe.getFile());
} catch (OutOfMemoryError oomerror)
{
new OOMWarning(
"When trying to open and map structures from Chimera!",
oomerror);
} catch (Exception ex)
{
Cache.log.error(
"Couldn't open " + pe.getFile() + " in Chimera viewer!",
ex);
} finally
{
Cache.log.debug("File locations are " + files);
}
}
}
jmb.refreshGUI();
jmb.setFinishedInit(true);
jmb.setLoadingFromArchive(false);
/*
* ensure that any newly discovered features (e.g. RESNUM)
* are added to any open feature settings dialog
*/
FeatureRenderer fr = getBinding().getFeatureRenderer(null);
if (fr != null)
{
fr.featuresAdded();
}
// refresh the sequence colours for the new structure(s)
for (AlignmentViewPanel ap : _colourwith)
{
jmb.updateColours(ap);
}
// do superposition if asked to
if (alignAddedStructures)
{
new Thread(new Runnable()
{
@Override
public void run()
{
alignStructsWithAllAlignPanels();
}
}).start();
}
addingStructures = false;
}
_started = false;
worker = null;
}
@Override
public void makePDBImage(TYPE imageType)
{
throw new UnsupportedOperationException(
"Image export for Chimera is not implemented");
}
@Override
public AAStructureBindingModel getBinding()
{
return jmb;
}
@Override
public ViewerType getViewerType()
{
return ViewerType.CHIMERA;
}
@Override
protected String getViewerName()
{
return "Chimera";
}
}