X-Git-Url: http://source.jalview.org/gitweb/?a=blobdiff_plain;f=src%2Fjalview%2Fgui%2FAppJmolBinding.java;h=34d930d73d15f74604b3978795d579b4befcdd70;hb=cb8e52fbbc5f725e3f7f48c672cdddb0690bd978;hp=aa6a15923c780d8ee0f2e05ba51a3c1a00293240;hpb=f2511dd2e8e37b8e999e924f8a53d150377b21b5;p=jalview.git diff --git a/src/jalview/gui/AppJmolBinding.java b/src/jalview/gui/AppJmolBinding.java index aa6a159..34d930d 100644 --- a/src/jalview/gui/AppJmolBinding.java +++ b/src/jalview/gui/AppJmolBinding.java @@ -20,24 +20,33 @@ */ package jalview.gui; -import jalview.api.AlignmentViewPanel; -import jalview.api.structures.JalviewStructureDisplayI; -import jalview.bin.Cache; -import jalview.datamodel.PDBEntry; -import jalview.datamodel.SequenceI; -import jalview.ext.jmol.JalviewJmolBinding; -import jalview.io.DataSourceType; -import jalview.structure.StructureSelectionManager; - import java.awt.Container; +import java.io.File; +import java.util.ArrayList; +import java.util.List; import java.util.Map; import javax.swing.JComponent; import org.jmol.api.JmolAppConsoleInterface; -import org.jmol.java.BS; import org.openscience.jmol.app.jmolpanel.console.AppConsole; +import jalview.api.AlignmentViewPanel; +import jalview.api.structures.JalviewStructureDisplayI; +import jalview.bin.Console; +import jalview.datamodel.AlignmentI; +import jalview.datamodel.PDBEntry; +import jalview.datamodel.SequenceI; +import jalview.ext.jmol.JalviewJmolBinding; +import jalview.io.DataSourceType; +import jalview.structure.StructureSelectionManager; +import jalview.util.MessageManager; +import jalview.util.Platform; +import jalview.ws.dbsources.EBIAlfaFold; +import jalview.ws.dbsources.Pdb; +import jalview.ws.utils.UrlDownloadClient; +import javajs.util.BS; + public class AppJmolBinding extends JalviewJmolBinding { public AppJmolBinding(AppJmol appJmol, StructureSelectionManager sSm, @@ -82,7 +91,7 @@ public class AppJmolBinding extends JalviewJmolBinding jalview.util.BrowserLauncher.openURL(url); } catch (Exception e) { - Cache.log.error("Failed to launch Jmol-associated url " + url, e); + Console.error("Failed to launch Jmol-associated url " + url, e); // TODO: 2.6 : warn user if browser was not configured. } } @@ -90,6 +99,11 @@ public class AppJmolBinding extends JalviewJmolBinding @Override public void refreshGUI() { + if (getMappedStructureCount() == 0) + { + // too soon! + return; + } // appJmolWindow.repaint(); javax.swing.SwingUtilities.invokeLater(new Runnable() { @@ -97,6 +111,7 @@ public class AppJmolBinding extends JalviewJmolBinding public void run() { JalviewStructureDisplayI theViewer = getViewer(); + // invokes colourbySequence() via seqColour_ActionPerformed() theViewer.updateTitleAndMenus(); ((JComponent) theViewer).revalidate(); } @@ -104,21 +119,6 @@ public class AppJmolBinding extends JalviewJmolBinding } @Override - public void updateColours(Object source) - { - AlignmentPanel ap = (AlignmentPanel) source; - // ignore events from panels not used to colour this view - if (!getViewer().isUsedForColourBy(ap)) - { - return; - } - if (!isLoadingFromArchive()) - { - colourBySequence(ap); - } - } - - @Override public void notifyScriptTermination(String strStatus, int msWalltime) { // todo - script termination doesn't happen ? @@ -142,15 +142,6 @@ public class AppJmolBinding extends JalviewJmolBinding @Override public void selectionChanged(BS arg0) { - // TODO Auto-generated method stub - - } - - @Override - public void refreshPdbEntries() - { - // TODO Auto-generated method stub - } @Override @@ -164,7 +155,9 @@ public class AppJmolBinding extends JalviewJmolBinding Container consolePanel, String buttonsToShow) { jmolViewer.setJmolCallbackListener(this); - return new AppConsole(jmolViewer, consolePanel, buttonsToShow); + // BH comment: can't do this yet [for JS only, or generally?] + return Platform.isJS() ? null + : new AppConsole(jmolViewer, consolePanel, buttonsToShow); } @Override @@ -189,4 +182,114 @@ public class AppJmolBinding extends JalviewJmolBinding // TODO Auto-generated method stub return null; } + + @SuppressWarnings("unused") + public void cacheFiles(List files) + { + if (files == null) + { + return; + } + for (File f : files) + { + Platform.cacheFileData(f); + } + } + + /** + * Retrieves and saves as file any modelled PDB entries for which we do not + * already have a file saved. Returns a list of absolute paths to structure + * files which were either retrieved, or already stored but not modelled in + * the structure viewer (i.e. files to add to the viewer display). + * + * Currently only used by Jmol - similar but different code used for Chimera/X + * and Pymol so still need to refactor + * + * @param structureViewer + * UI proxy for the structure viewer + * @return list of absolute paths to structures retrieved that need to be + * added to the display + */ + public List fetchPdbFiles(StructureViewerBase structureViewer) + { + // todo - record which pdbids were successfully imported. + StringBuilder errormsgs = new StringBuilder(); + + List files = new ArrayList<>(); + String pdbid = ""; + try + { + String[] filesInViewer = getStructureFiles(); + // TODO: replace with reference fetching/transfer code (validate PDBentry + // as a DBRef?) + + for (int pi = 0; pi < getPdbCount(); pi++) + { + PDBEntry strucEntry = getPdbEntry(pi); + + String file = strucEntry.getFile(); + if (file == null) + { + pdbid = strucEntry.getId(); + try{ + file = structureViewer.fetchPdbFile(strucEntry); + } catch (OutOfMemoryError oomerror) + { + new OOMWarning("Retrieving PDB id " + pdbid, oomerror); + } catch (Exception ex) + { + ex.printStackTrace(); + errormsgs.append("'").append(pdbid).append("'"); + } + if (file!=null) + { + // success + files.add(file); + } + else + { + errormsgs.append("'").append(pdbid).append("' "); + } + } + else + { + if (filesInViewer != null && filesInViewer.length > 0) + { + structureViewer.setAddingStructures(true); // already files loaded. + for (int c = 0; c < filesInViewer.length; c++) + { + if (Platform.pathEquals(filesInViewer[c], file)) + { + file = null; + break; + } + } + } + if (file != null) + { + files.add(file); + } + } + } + } catch (OutOfMemoryError oomerror) + { + new OOMWarning("Retrieving PDB files: " + pdbid, oomerror); + } catch (Exception ex) + { + ex.printStackTrace(); + errormsgs.append("When retrieving pdbfiles : current was: '") + .append(pdbid).append("'"); + } + if (errormsgs.length() > 0) + { + JvOptionPane.showInternalMessageDialog(Desktop.desktop, + MessageManager.formatMessage( + "label.pdb_entries_couldnt_be_retrieved", new String[] + { errormsgs.toString() }), + MessageManager.getString("label.couldnt_load_file"), + JvOptionPane.ERROR_MESSAGE); + } + return files; + } + }