X-Git-Url: http://source.jalview.org/gitweb/?a=blobdiff_plain;f=src%2Fjalview%2Fstructure%2FStructureSelectionManager.java;h=db0b47edc14e51f0648e37f1096e7d743784f89b;hb=136c0793b90b72b928c4d77dc109dd5c644e00d3;hp=da529407c1ea841cef6c6df0044e3548ad176fac;hpb=3ab582bfeeab1563bedf60e97994e63e672d2e31;p=jalview.git diff --git a/src/jalview/structure/StructureSelectionManager.java b/src/jalview/structure/StructureSelectionManager.java index da52940..db0b47e 100644 --- a/src/jalview/structure/StructureSelectionManager.java +++ b/src/jalview/structure/StructureSelectionManager.java @@ -1,6 +1,6 @@ /* - * Jalview - A Sequence Alignment Editor and Viewer (Version 2.9.0b2) - * Copyright (C) 2015 The Jalview Authors + * Jalview - A Sequence Alignment Editor and Viewer ($$Version-Rel$$) + * Copyright (C) $$Year-Rel$$ The Jalview Authors * * This file is part of Jalview. * @@ -29,12 +29,15 @@ import jalview.datamodel.AlignedCodonFrame; import jalview.datamodel.AlignmentAnnotation; import jalview.datamodel.AlignmentI; import jalview.datamodel.Annotation; +import jalview.datamodel.HiddenColumns; import jalview.datamodel.PDBEntry; import jalview.datamodel.SearchResults; +import jalview.datamodel.SearchResultsI; import jalview.datamodel.SequenceI; import jalview.ext.jmol.JmolParser; import jalview.gui.IProgressIndicator; import jalview.io.AppletFormatAdapter; +import jalview.io.DataSourceType; import jalview.io.StructureFile; import jalview.util.MappingUtils; import jalview.util.MessageManager; @@ -322,7 +325,7 @@ public class StructureSelectionManager * @return null or the structure data parsed as a pdb file */ synchronized public StructureFile setMapping(SequenceI[] sequence, - String[] targetChains, String pdbFile, String protocol) + String[] targetChains, String pdbFile, DataSourceType protocol) { return setMapping(true, sequence, targetChains, pdbFile, protocol); } @@ -341,13 +344,13 @@ public class StructureSelectionManager * (may be nill, individual elements may be nill) * @param pdbFile * - structure data resource - * @param protocol + * @param sourceType * - how to resolve data from resource * @return null or the structure data parsed as a pdb file */ synchronized public StructureFile setMapping(boolean forStructureView, SequenceI[] sequenceArray, String[] targetChainIds, - String pdbFile, String protocol) + String pdbFile, DataSourceType sourceType) { /* * There will be better ways of doing this in the future, for now we'll use @@ -383,15 +386,16 @@ public class StructureSelectionManager boolean isMapUsingSIFTs = SiftsSettings.isMapWithSifts(); try { - pdb = new JmolParser(pdbFile, protocol); + sourceType = AppletFormatAdapter.checkProtocol(pdbFile); + pdb = new JmolParser(pdbFile, sourceType); if (pdb.getId() != null && pdb.getId().trim().length() > 0 - && AppletFormatAdapter.FILE.equals(protocol)) + && DataSourceType.FILE == sourceType) { registerPDBFile(pdb.getId().trim(), pdbFile); } // if PDBId is unavailable then skip SIFTS mapping execution path - isMapUsingSIFTs = pdb.isPPDBIdAvailable(); + isMapUsingSIFTs = isMapUsingSIFTs && pdb.isPPDBIdAvailable(); } catch (Exception ex) { @@ -453,7 +457,7 @@ public class StructureSelectionManager * Attempt pairwise alignment of the sequence with each chain in the PDB, * and remember the highest scoring chain */ - int max = -10; + float max = -10; AlignSeq maxAlignseq = null; String maxChainId = " "; PDBChain maxChain = null; @@ -490,12 +494,12 @@ public class StructureSelectionManager continue; } - if (protocol.equals(jalview.io.AppletFormatAdapter.PASTE)) + if (sourceType == DataSourceType.PASTE) { pdbFile = "INLINE" + pdb.getId(); } - ArrayList seqToStrucMapping = new ArrayList(); + List seqToStrucMapping = new ArrayList(); if (isMapUsingSIFTs && seq.isProtein()) { setProgressBar(null); @@ -533,7 +537,7 @@ public class StructureSelectionManager } else { - ArrayList foundSiftsMappings = new ArrayList(); + List foundSiftsMappings = new ArrayList(); for (PDBChain chain : pdb.getChains()) { try @@ -588,11 +592,9 @@ public class StructureSelectionManager return pdb; } - private boolean isCIFFile(String filename) + public void addStructureMapping(StructureMapping sm) { - String fileExt = filename.substring(filename.lastIndexOf(".") + 1, - filename.length()); - return "cif".equalsIgnoreCase(fileExt); + mappings.add(sm); } /** @@ -740,7 +742,7 @@ public class StructureSelectionManager if (listeners.elementAt(i) instanceof StructureListener) { sl = (StructureListener) listeners.elementAt(i); - for (String pdbfile : sl.getPdbFile()) + for (String pdbfile : sl.getStructureFiles()) { pdbs.remove(pdbfile); } @@ -805,7 +807,28 @@ public class StructureSelectionManager return; } - SearchResults results = new SearchResults(); + SearchResultsI results = findAlignmentPositionsForStructurePositions(atoms); + for (Object li : listeners) + { + if (li instanceof SequenceListener) + { + ((SequenceListener) li).highlightSequence(results); + } + } + } + + /** + * Constructs a SearchResults object holding regions (if any) in the Jalview + * alignment which have a mapping to the structure viewer positions in the + * supplied list + * + * @param atoms + * @return + */ + public SearchResultsI findAlignmentPositionsForStructurePositions( + List atoms) + { + SearchResultsI results = new SearchResults(); for (AtomSpec atom : atoms) { SequenceI lastseq = null; @@ -830,13 +853,7 @@ public class StructureSelectionManager } } } - for (Object li : listeners) - { - if (li instanceof SequenceListener) - { - ((SequenceListener) li).highlightSequence(results); - } - } + return results; } /** @@ -855,7 +872,7 @@ public class StructureSelectionManager { boolean hasSequenceListeners = handlingVamsasMo || !seqmappings.isEmpty(); - SearchResults results = null; + SearchResultsI results = null; if (seqPos == -1) { seqPos = seq.findPosition(indexpos); @@ -1187,13 +1204,14 @@ public class StructureSelectionManager public synchronized void sendSelection( jalview.datamodel.SequenceGroup selection, - jalview.datamodel.ColumnSelection colsel, SelectionSource source) + jalview.datamodel.ColumnSelection colsel, HiddenColumns hidden, + SelectionSource source) { for (SelectionListener slis : sel_listeners) { if (slis != source) { - slis.selection(selection, colsel, source); + slis.selection(selection, colsel, hidden, source); } } }