X-Git-Url: http://source.jalview.org/gitweb/?a=blobdiff_plain;f=src%2Fjalview%2Fws%2Fdbsources%2FPdb.java;h=3fd7541fb25fbb2fa76efe29f634e16b823dca3e;hb=refs%2Fheads%2Fmungo_develop;hp=a352de689699f65b411a4bf071476324a683584e;hpb=aced09c4feeaf3406269442c14e54abeeb4cad81;p=jalview.git diff --git a/src/jalview/ws/dbsources/Pdb.java b/src/jalview/ws/dbsources/Pdb.java index a352de6..3fd7541 100644 --- a/src/jalview/ws/dbsources/Pdb.java +++ b/src/jalview/ws/dbsources/Pdb.java @@ -1,6 +1,6 @@ /* - * Jalview - A Sequence Alignment Editor and Viewer (Version 2.8.2) - * Copyright (C) 2014 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. * @@ -20,37 +20,31 @@ */ package jalview.ws.dbsources; -import jalview.datamodel.Alignment; +import jalview.datamodel.AlignmentAnnotation; +import jalview.datamodel.AlignmentI; import jalview.datamodel.DBRefEntry; import jalview.datamodel.DBRefSource; import jalview.datamodel.PDBEntry; import jalview.datamodel.SequenceI; +import jalview.io.FormatAdapter; +import jalview.util.MessageManager; +import jalview.ws.ebi.EBIFetchClient; import java.util.ArrayList; import java.util.List; import java.util.Vector; -import MCview.PDBChain; -import MCview.PDBfile; - import com.stevesoft.pat.Regex; -import jalview.datamodel.AlignmentI; -import jalview.io.FormatAdapter; -import jalview.util.MessageManager; -import jalview.ws.ebi.EBIFetchClient; -import jalview.ws.seqfetcher.DbSourceProxy; - /** * @author JimP * */ -public class Pdb extends EbiFileRetrievedProxy implements DbSourceProxy +public class Pdb extends EbiFileRetrievedProxy { public Pdb() { super(); - addDbSourceProperty(DBRefSource.PROTSEQDB); } /* @@ -58,6 +52,7 @@ public class Pdb extends EbiFileRetrievedProxy implements DbSourceProxy * * @see jalview.ws.DbSourceProxy#getAccessionSeparator() */ + @Override public String getAccessionSeparator() { // TODO Auto-generated method stub @@ -69,6 +64,7 @@ public class Pdb extends EbiFileRetrievedProxy implements DbSourceProxy * * @see jalview.ws.DbSourceProxy#getAccessionValidator() */ + @Override public Regex getAccessionValidator() { return new Regex("([1-9][0-9A-Za-z]{3}):?([ _A-Za-z0-9]?)"); @@ -79,6 +75,7 @@ public class Pdb extends EbiFileRetrievedProxy implements DbSourceProxy * * @see jalview.ws.DbSourceProxy#getDbSource() */ + @Override public String getDbSource() { return DBRefSource.PDB; @@ -89,6 +86,7 @@ public class Pdb extends EbiFileRetrievedProxy implements DbSourceProxy * * @see jalview.ws.DbSourceProxy#getDbVersion() */ + @Override public String getDbVersion() { return "0"; @@ -99,9 +97,10 @@ public class Pdb extends EbiFileRetrievedProxy implements DbSourceProxy * * @see jalview.ws.DbSourceProxy#getSequenceRecords(java.lang.String[]) */ + @Override public AlignmentI getSequenceRecords(String queries) throws Exception { - AlignmentI pdbfile = null; + AlignmentI pdbAlignment = null; Vector result = new Vector(); String chain = null; String id = null; @@ -135,20 +134,20 @@ public class Pdb extends EbiFileRetrievedProxy implements DbSourceProxy try { - pdbfile = new FormatAdapter().readFile(file, + pdbAlignment = new FormatAdapter().readFile(file, jalview.io.AppletFormatAdapter.FILE, "PDB"); - if (pdbfile != null) + if (pdbAlignment != null) { List toremove = new ArrayList(); - for (SequenceI pdbcs : pdbfile.getSequences()) + for (SequenceI pdbcs : pdbAlignment.getSequences()) { String chid = null; // Mapping map=null; - for (PDBEntry pid : (Vector) pdbcs.getPDBId()) + for (PDBEntry pid : pdbcs.getAllPDBEntries()) { if (pid.getFile() == file) { - chid = (String) pid.getProperty().get("CHAIN"); + chid = pid.getChainCode(); } ; @@ -192,13 +191,22 @@ public class Pdb extends EbiFileRetrievedProxy implements DbSourceProxy // now remove marked sequences for (SequenceI pdbcs : toremove) { - pdbfile.deleteSequence(pdbcs); + pdbAlignment.deleteSequence(pdbcs); + if (pdbcs.getAnnotation() != null) + { + for (AlignmentAnnotation aa : pdbcs.getAnnotation()) + { + pdbAlignment.deleteAnnotation(aa); + } + } } } - if (pdbfile == null || pdbfile.getHeight() < 1) + if (pdbAlignment == null || pdbAlignment.getHeight() < 1) { - throw new Exception(MessageManager.formatMessage("exception.no_pdb_records_for_chain", new String[]{id, ((chain == null) ? "' '" : chain)})); + throw new Exception(MessageManager.formatMessage( + "exception.no_pdb_records_for_chain", new String[] { id, + ((chain == null) ? "' '" : chain) })); } } catch (Exception ex) // Problem parsing PDB file @@ -206,7 +214,7 @@ public class Pdb extends EbiFileRetrievedProxy implements DbSourceProxy stopQuery(); throw (ex); } - return pdbfile; + return pdbAlignment; } /* @@ -214,6 +222,7 @@ public class Pdb extends EbiFileRetrievedProxy implements DbSourceProxy * * @see jalview.ws.DbSourceProxy#isValidReference(java.lang.String) */ + @Override public boolean isValidReference(String accession) { Regex r = getAccessionValidator(); @@ -223,11 +232,13 @@ public class Pdb extends EbiFileRetrievedProxy implements DbSourceProxy /** * obtain human glyoxalase chain A sequence */ + @Override public String getTestQuery() { return "1QIPA"; } + @Override public String getDbName() { return "PDB"; // getDbSource();