X-Git-Url: http://source.jalview.org/gitweb/?a=blobdiff_plain;f=src%2Fjalview%2Fio%2FStructureFile.java;h=3025907fe46adc023add9e13001dddebcf85dae2;hb=582096635d0502a9bc8415c8f1ef3bcc9c545a44;hp=97b246f25987dd0ef8e51ef98a5befd85ec69d33;hpb=c96c7cbd9b1cf8b2f0c0715180e698f6c3f657d1;p=jalview.git diff --git a/src/jalview/io/StructureFile.java b/src/jalview/io/StructureFile.java index 97b246f..3025907 100644 --- a/src/jalview/io/StructureFile.java +++ b/src/jalview/io/StructureFile.java @@ -42,14 +42,8 @@ import MCview.PDBChain; public abstract class StructureFile extends AlignFile { - private String id; - public enum StructureFileType - { - PDB, MMCIF, MMTF - }; - private PDBEntry.Type dbRefType; /** @@ -74,9 +68,10 @@ public abstract class StructureFile extends AlignFile private boolean pdbIdAvailable; - public StructureFile(String inFile, String type) throws IOException + public StructureFile(String inFile, DataSourceType sourceType) + throws IOException { - super(inFile, type); + super(inFile, sourceType); } public StructureFile(FileParse fp) throws IOException @@ -104,9 +99,9 @@ public abstract class StructureFile extends AlignFile } public StructureFile(boolean parseImmediately, String dataObject, - String type) throws IOException + DataSourceType sourceType) throws IOException { - super(parseImmediately, dataObject, type); + super(parseImmediately, dataObject, sourceType); } public StructureFile(boolean a, FileParse fp) throws IOException @@ -196,11 +191,13 @@ public abstract class StructureFile extends AlignFile { // TODO: use the PDB ID of the structure if one is available, to save // bandwidth and avoid uploading the whole structure to the service - Object annotate3d = cl.getConstructor(new Class[] {}).newInstance( - new Object[] {}); - AlignmentI al = ((AlignmentI) cl.getMethod("getRNAMLFor", - new Class[] { FileParse.class }).invoke(annotate3d, - new Object[] { new FileParse(getDataName(), type) })); + Object annotate3d = cl.getConstructor(new Class[] {}) + .newInstance(new Object[] {}); + AlignmentI al = ((AlignmentI) cl + .getMethod("getRNAMLFor", new Class[] + { FileParse.class }) + .invoke(annotate3d, new Object[] + { new FileParse(getDataName(), dataSourceType) })); for (SequenceI sq : al.getSequences()) { if (sq.getDatasetSequence() != null) @@ -227,8 +224,8 @@ public abstract class StructureFile extends AlignFile } @SuppressWarnings("unchecked") - protected void replaceAndUpdateChains(List prot, - AlignmentI al, String pep, boolean b) + protected void replaceAndUpdateChains(List prot, AlignmentI al, + String pep, boolean b) { List> replaced = AlignSeq .replaceMatchingSeqsWith(seqs, annotations, prot, al, pep, @@ -293,8 +290,8 @@ public abstract class StructureFile extends AlignFile processWithJmolParser(proteinSequences); } catch (Exception x) { - System.err - .println("Exceptions from Jmol when processing data in pdb file"); + System.err.println( + "Exceptions from Jmol when processing data in pdb file"); x.printStackTrace(); } } @@ -310,9 +307,10 @@ public abstract class StructureFile extends AlignFile if (cl != null) { final Constructor constructor = cl - .getConstructor(new Class[] { FileParse.class }); - final Object[] args = new Object[] { new FileParse(getDataName(), - type) }; + .getConstructor(new Class[] + { FileParse.class }); + final Object[] args = new Object[] { + new FileParse(getDataName(), dataSourceType) }; StructureImportSettings.setShowSeqFeatures(false); StructureImportSettings.setVisibleChainAnnotation(false); @@ -321,8 +319,8 @@ public abstract class StructureFile extends AlignFile StructureImportSettings .setExternalSecondaryStructure(externalSecondaryStructure); Object jmf = constructor.newInstance(args); - AlignmentI al = new Alignment((SequenceI[]) cl.getMethod( - "getSeqsAsArray", new Class[] {}).invoke(jmf)); + AlignmentI al = new Alignment((SequenceI[]) cl + .getMethod("getSeqsAsArray", new Class[] {}).invoke(jmf)); cl.getMethod("addAnnotations", new Class[] { AlignmentI.class }) .invoke(jmf, al); for (SequenceI sq : al.getSequences()) @@ -399,8 +397,10 @@ public abstract class StructureFile extends AlignFile public static boolean isRNA(SequenceI seq) { - for (char c : seq.getSequence()) + int length = seq.getLength(); + for (int i = 0; i < length; i++) { + char c = seq.getCharAt(i); if ((c != 'A') && (c != 'C') && (c != 'G') && (c != 'U')) { return false; @@ -413,7 +413,8 @@ public abstract class StructureFile extends AlignFile * make a friendly ID string. * * @param dataName - * @return truncated dataName to after last '/' + * @return truncated dataName to after last '/' and pruned .extension if + * present */ protected String safeName(String dataName) { @@ -422,6 +423,10 @@ public abstract class StructureFile extends AlignFile { dataName = dataName.substring(p + 1); } + if (dataName.indexOf(".") > -1) + { + dataName = dataName.substring(0, dataName.lastIndexOf(".")); + } return dataName; } @@ -489,20 +494,4 @@ public abstract class StructureFile extends AlignFile { this.pdbIdAvailable = pdbIdAvailable; } - - public static boolean isStructureFile(String fileType) - { - if (fileType == null) - { - return false; - } - for (StructureFileType sfType : StructureFileType.values()) - { - if (sfType.name().equalsIgnoreCase(fileType)) - { - return true; - } - } - return false; - } }