X-Git-Url: http://source.jalview.org/gitweb/?a=blobdiff_plain;f=src%2Fjalview%2Fws%2Fsifts%2FSiftsClient.java;h=0e9e88855704086a63f373c5c4fcd6c6dd78d0a9;hb=fa1b96bdca9954d44de8ed08e106ace44dcf66c3;hp=37388d3c1a18d56c580b382db224501093bb33e1;hpb=0ed5b947087f831b8673f4c4e423bd4ef2238a89;p=jalview.git diff --git a/src/jalview/ws/sifts/SiftsClient.java b/src/jalview/ws/sifts/SiftsClient.java index 37388d3..0e9e888 100644 --- a/src/jalview/ws/sifts/SiftsClient.java +++ b/src/jalview/ws/sifts/SiftsClient.java @@ -21,6 +21,8 @@ package jalview.ws.sifts; import jalview.analysis.AlignSeq; +import jalview.analysis.scoremodels.ScoreMatrix; +import jalview.analysis.scoremodels.ScoreModels; import jalview.api.DBRefEntryI; import jalview.api.SiftsClientI; import jalview.datamodel.DBRefEntry; @@ -295,6 +297,7 @@ public class SiftsClient implements SiftsClientI siftsDownloadDir.mkdirs(); } // System.out.println(">> Download ftp url : " + siftsFileFTPURL); + // long now = System.currentTimeMillis(); URL url = new URL(siftsFileFTPURL); URLConnection conn = url.openConnection(); InputStream inputStream = conn.getInputStream(); @@ -308,7 +311,8 @@ public class SiftsClient implements SiftsClientI } outputStream.close(); inputStream.close(); - // System.out.println(">>> File downloaded : " + downloadedSiftsFile); +// System.out.println(">>> File downloaded : " + downloadedSiftsFile +// + " took " + (System.currentTimeMillis() - now) + "ms"); return new File(downloadedSiftsFile); } @@ -605,8 +609,12 @@ public class SiftsClient implements SiftsClientI .getDbResNum()); } catch (NumberFormatException nfe) { - resNum = (pdbRefDb == null) ? Integer.valueOf(residue - .getDbResNum()) : Integer.valueOf(pdbRefDb + if (pdbRefDb == null || pdbRefDb.getDbResNum().equals("null")) + { + resNum = UNASSIGNED; + continue; + } + resNum = Integer.valueOf(pdbRefDb .getDbResNum().split("[a-zA-Z]")[0]); continue; } @@ -955,7 +963,7 @@ public class SiftsClient implements SiftsClientI } @Override - public StringBuffer getMappingOutput(MappingOutputPojo mp) + public StringBuilder getMappingOutput(MappingOutputPojo mp) throws SiftsException { String seqRes = mp.getSeqResidue(); @@ -977,7 +985,7 @@ public class SiftsClient implements SiftsClientI int nochunks = ((seqRes.length()) / len) + ((seqRes.length()) % len > 0 ? 1 : 0); // output mappings - StringBuffer output = new StringBuffer(); + StringBuilder output = new StringBuilder(512); output.append(NEWLINE); output.append("Sequence \u27f7 Structure mapping details").append( NEWLINE); @@ -998,6 +1006,7 @@ public class SiftsClient implements SiftsClientI output.append(String.valueOf(pdbEnd)); output.append(NEWLINE).append(NEWLINE); + ScoreMatrix pam250 = ScoreModels.getInstance().getPam250(); int matchedSeqCount = 0; for (int j = 0; j < nochunks; j++) { @@ -1016,27 +1025,29 @@ public class SiftsClient implements SiftsClientI output.append(NEWLINE); output.append(new Format("%" + (maxid) + "s").form(" ")).append(" "); - // Print out the matching chars + /* + * Print out the match symbols: + * | for exact match (ignoring case) + * . if PAM250 score is positive + * else a space + */ for (int i = 0; i < len; i++) { try { if ((i + (j * len)) < seqRes.length()) { - boolean sameChar = Comparison.isSameResidue( - seqRes.charAt(i + (j * len)), - strRes.charAt(i + (j * len)), false); - if (sameChar - && !jalview.util.Comparison.isGap(seqRes.charAt(i - + (j * len)))) + char c1 = seqRes.charAt(i + (j * len)); + char c2 = strRes.charAt(i + (j * len)); + boolean sameChar = Comparison.isSameResidue(c1, c2, false); + if (sameChar && !Comparison.isGap(c1)) { matchedSeqCount++; output.append("|"); } else if (type.equals("pep")) { - if (ResidueProperties.getPAM250(seqRes.charAt(i + (j * len)), - strRes.charAt(i + (j * len))) > 0) + if (pam250.getPairwiseScore(c1, c2) > 0) { output.append("."); }