X-Git-Url: http://source.jalview.org/gitweb/?a=blobdiff_plain;f=src%2Fjalview%2Fdatamodel%2FPDBEntry.java;h=7c2d2909274363e60b8ff57fc973c369aff834b5;hb=6c96743ff6c65895e4b96523d0e3d05f6dc3cb01;hp=253586455a9394fbe5dd1e354d481e59178e8972;hpb=d423f22792e47dbc800ae220a58677f988971d06;p=jalview.git diff --git a/src/jalview/datamodel/PDBEntry.java b/src/jalview/datamodel/PDBEntry.java index 2535864..7c2d290 100755 --- a/src/jalview/datamodel/PDBEntry.java +++ b/src/jalview/datamodel/PDBEntry.java @@ -1,39 +1,88 @@ /* - * Jalview - A Sequence Alignment Editor and Viewer (Version 2.5) - * Copyright (C) 2010 J Procter, AM Waterhouse, G Barton, M Clamp, S Searle + * Jalview - A Sequence Alignment Editor and Viewer ($$Version-Rel$$) + * Copyright (C) $$Year-Rel$$ The Jalview Authors * * This file is part of Jalview. * * Jalview is free software: you can redistribute it and/or * modify it under the terms of the GNU General Public License - * as published by the Free Software Foundation, either version 3 of the License, or (at your option) any later version. - * + * as published by the Free Software Foundation, either version 3 + * of the License, or (at your option) any later version. + * * Jalview is distributed in the hope that it will be useful, but * WITHOUT ANY WARRANTY; without even the implied warranty * of MERCHANTABILITY or FITNESS FOR A PARTICULAR * PURPOSE. See the GNU General Public License for more details. * - * You should have received a copy of the GNU General Public License along with Jalview. If not, see . + * You should have received a copy of the GNU General Public License + * along with Jalview. If not, see . + * The Jalview Authors are detailed in the 'AUTHORS' file. */ package jalview.datamodel; -import java.util.*; +import jalview.util.CaseInsensitiveString; + +import java.util.Collections; +import java.util.Enumeration; +import java.util.Hashtable; +import java.util.Map.Entry; public class PDBEntry { - String file; - String type; + /** + * constant for storing chain code in properties table + */ + private static final String CHAIN_ID = "chain_code"; + + Hashtable properties; + + private String file; + + private String type; + + private String id; + + public enum Type + { + PDB, MMCIF, FILE; + /** + * case insensitive matching for Type enum + * + * @param value + * @return + */ + public static Type getType(String value) + { + for (Type t : Type.values()) + { + if (t.toString().equalsIgnoreCase(value)) + { + return t; + } + } + return null; + } - String id; + /** + * case insensitive equivalence for strings resolving to PDBEntry type + * + * @param t + * @return + */ + public boolean matches(String t) + { + return (this.toString().equalsIgnoreCase(t)); + } + } - Hashtable properties; /* * (non-Javadoc) * * @see java.lang.Object#equals(java.lang.Object) */ + @Override public boolean equals(Object obj) { if (obj == null || !(obj instanceof PDBEntry)) @@ -41,23 +90,52 @@ public class PDBEntry return false; } if (obj == this) + { return true; + } PDBEntry o = (PDBEntry) obj; - return (file == o.file || (file != null && o.file != null && o.file - .equals(file))) - && (type == o.type || (type != null && o.type != null && o.type - .equals(type))) + return (type == o.type || (type != null && o.type != null && o.type + .equals(type))) && (id == o.id || (id != null && o.id != null && o.id .equalsIgnoreCase(id))) && (properties == o.properties || (properties != null && o.properties != null && properties - .equals(o.properties))); + .equals(o.properties))); + } + /** + * Default constructor + */ public PDBEntry() { } + /** + * Constructor given file path and PDB id. + * + * @param filePath + */ + // public PDBEntry(String filePath, String pdbId) + // { + // this.file = filePath; + // this.id = pdbId; + // } + + public PDBEntry(String pdbId, String chain, PDBEntry.Type type, + String filePath) + { + this.id = pdbId; + this.type = type == null ? null : type.toString(); + this.file = filePath; + setChainCode(chain); + } + + /** + * Copy constructor. + * + * @param entry + */ public PDBEntry(PDBEntry entry) { file = entry.file; @@ -65,13 +143,13 @@ public class PDBEntry id = entry.id; if (entry.properties != null) { - properties = (Hashtable) entry.properties.clone(); + properties = (Hashtable) entry.properties.clone(); } } - public void setFile(String file) + public void setFile(String f) { - this.file = file; + this.file = f; } public String getFile() @@ -79,9 +157,14 @@ public class PDBEntry return file; } - public void setType(String type) + public void setType(String t) { - this.type = type; + this.type = t; + } + + public void setType(PDBEntry.Type type) + { + this.type = type == null ? null : type.toString(); } public String getType() @@ -99,14 +182,154 @@ public class PDBEntry return id; } - public void setProperty(Hashtable property) + public void setProperty(String key, Object value) { - this.properties = property; + if (this.properties == null) + { + this.properties = new Hashtable(); + } + properties.put(key, value); } - public Hashtable getProperty() + public Object getProperty(String key) + { + return properties == null ? null : properties.get(key); + } + + /** + * Returns an enumeration of the keys of this object's properties (or an empty + * enumeration if it has no properties) + * + * @return + */ + public Enumeration getProperties() + { + if (properties == null) + { + return Collections.emptyEnumeration(); + } + return properties.keys(); + } + + /** + * + * @return null or a string for associated chain IDs + */ + public String getChainCode() + { + return (properties == null || properties.get(CHAIN_ID) == null) ? null + : properties.get(CHAIN_ID).toString(); + } + + /** + * Sets a non-case-sensitive property for the given chain code. Two PDBEntry + * objects which differ only in the case of their chain code are considered + * equal. This avoids duplication of objects in lists of PDB ids. + * + * @param chainCode + */ + public void setChainCode(String chainCode) + { + if (chainCode == null) + { + deleteProperty(CHAIN_ID); + } + else + { + setProperty(CHAIN_ID, new CaseInsensitiveString(chainCode)); + } + } + + /** + * Deletes the property with the given key, and returns the deleted value (or + * null) + */ + Object deleteProperty(String key) + { + Object result = null; + if (properties != null) + { + result = properties.remove(key); + } + return result; + } + + @Override + public String toString() + { + return id; + } + + /** + * Getter provided for Castor binding only. Application code should call + * getProperty() or getProperties() instead. + * + * @deprecated + * @see #getProperty(String) + * @see #getProperties() + * @see jalview.ws.dbsources.Uniprot#getUniprotEntries + * @return + */ + @Deprecated + public Hashtable getProps() { return properties; } + /** + * Setter provided for Castor binding only. Application code should call + * setProperty() instead. + * + * @deprecated + * @return + */ + @Deprecated + public void setProps(Hashtable props) + { + properties = props; + } + + /** + * update entry with details from another entry concerning the same PDB + * ID/file spec. + * + * @param newEntry + * @return true if modifications were made + */ + public boolean updateFrom(PDBEntry newEntry) + { + boolean modified = false; + + if (getFile() == null) + { + // update file and type of file + modified = newEntry.getFile() != null; + setFile(newEntry.getFile()); + } + if (newEntry.getType() != null && newEntry.getFile() != null + && newEntry.getFile().equals(getFile())) + { + setType(newEntry.getType()); + } + if (getChainCode() == null + || (getChainCode() != null && getChainCode().length() == 0 && newEntry + .getChainCode() != null)) + { + modified |= (getChainCode() == null || !newEntry.getChainCode() + .equals(getChainCode())); + setChainCode(newEntry.getChainCode()); + } + if (newEntry.properties != null) + { + for (Entry entry : newEntry.properties.entrySet()) + { + if (!entry.getValue().equals(getProperty(entry.getKey()))) + { + modified = true; + } + setProperty(entry.getKey(), entry.getValue()); + } + } + return modified; + } }