/* $Revision$ $Author$ $Date$ * * Copyright (C) 1997-2007 Christoph Steinbeck <steinbeck@users.sf.net> * * Contact: cdk-devel@lists.sourceforge.net * * This program is free software; you can redistribute it and/or * modify it under the terms of the GNU Lesser General Public License * as published by the Free Software Foundation; either version 2.1 * of the License, or (at your option) any later version. * All we ask is that proper credit is given for our work, which includes * - but is not limited to - adding the above copyright notice to the beginning * of your source code files, and to any copyright notice that you may distribute * with programs based on this work. * * This program 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 Lesser General Public License for more details. * * You should have received a copy of the GNU Lesser General Public License * along with this program; if not, write to the Free Software * Foundation, Inc., 51 Franklin St, Fifth Floor, Boston, MA 02110-1301 USA. * */ package org.openscience.cdk; import java.io.Serializable; import java.util.ArrayList; import java.util.HashMap; import java.util.Iterator; import java.util.List; import java.util.Map; import org.openscience.cdk.event.ChemObjectChangeEvent; import org.openscience.cdk.interfaces.IChemObject; import org.openscience.cdk.interfaces.IChemObjectBuilder; import org.openscience.cdk.interfaces.IChemObjectChangeEvent; import org.openscience.cdk.interfaces.IChemObjectListener; /** * The base class for all chemical objects in this cdk. It provides methods for * adding listeners and for their notification of events, as well a a hash * table for administration of physical or chemical properties * *@author steinbeck * @cdk.githash *@cdk.module data */ public class ChemObject implements Serializable, IChemObject, Cloneable { /** * Determines if a de-serialized object is compatible with this class. * * This value must only be changed if and only if the new version * of this class is incompatible with the old version. See Sun docs * for <a href=http://java.sun.com/products/jdk/1.1/docs/guide * /serialization/spec/version.doc.html>details</a>. */ private static final long serialVersionUID = 2798134548764323328L; /** * List for listener administration. */ private List<IChemObjectListener> chemObjectListeners; /** * A hashtable for the storage of any kind of properties of this IChemObject. */ private Map<Object, Object> properties; /** * You will frequently have to use some flags on a IChemObject. For example, if * you want to draw a molecule and see if you've already drawn an atom, or in * a ring search to check whether a vertex has been visited in a graph * traversal. Use these flags while addressing particular positions in the * flag array with self-defined constants (flags[VISITED] = true). 100 flags * per object should be more than enough. */ private boolean[] flags; /** * The ID is null by default. */ private String identifier; /** * Constructs a new IChemObject. */ public ChemObject() { flags = new boolean[CDKConstants.MAX_FLAG_INDEX + 1]; chemObjectListeners = null; properties = null; identifier = null; } /** * Constructs a new IChemObject by copying the flags, and the * identifier. It does not copy the listeners and properties. * * @param chemObject the object to copy */ public ChemObject(IChemObject chemObject) { // copy the flags boolean[] oldflags = chemObject.getFlags(); flags = new boolean[oldflags.length]; System.arraycopy(oldflags, 0, flags, 0, flags.length); // copy the identifier identifier = chemObject.getID(); } /** * Lazy creation of chemObjectListeners List. * *@return List with the ChemObjects associated. */ private List<IChemObjectListener> lazyChemObjectListeners() { if (chemObjectListeners == null) { chemObjectListeners = new ArrayList<IChemObjectListener>(); } return chemObjectListeners; } /** * Use this to add yourself to this IChemObject as a listener. In order to do * so, you must implement the ChemObjectListener Interface. * *@param col the ChemObjectListener *@see #removeListener */ public void addListener(IChemObjectListener col) { List<IChemObjectListener> listeners = lazyChemObjectListeners(); if (!listeners.contains(col)) { listeners.add(col); } // Should we throw an exception if col is already in here or // just silently ignore it? } /** * Returns the number of ChemObjectListeners registered with this object. * *@return the number of registered listeners. */ public int getListenerCount() { if (chemObjectListeners == null) { return 0; } return lazyChemObjectListeners().size(); } /** * Use this to remove a ChemObjectListener from the ListenerList of this * IChemObject. It will then not be notified of change in this object anymore. * *@param col The ChemObjectListener to be removed *@see #addListener */ public void removeListener(IChemObjectListener col) { if (chemObjectListeners == null) { return; } List<IChemObjectListener> listeners = lazyChemObjectListeners(); if (listeners.contains(col)) { listeners.remove(col); } } /** * This should be triggered by an method that changes the content of an object * to that the registered listeners can react to it. */ public void notifyChanged() { if (getNotification() && getListenerCount() > 0) { List<IChemObjectListener> listeners = lazyChemObjectListeners(); for (Object listener : listeners) { ((IChemObjectListener) listener).stateChanged( new ChemObjectChangeEvent(this) ); } } } /** * This should be triggered by an method that changes the content of an object * to that the registered listeners can react to it. This is a version of * notifyChanged() which allows to propagate a change event while preserving * the original origin. * *@param evt A ChemObjectChangeEvent pointing to the source of where * the change happend */ public void notifyChanged(IChemObjectChangeEvent evt) { if (getNotification() && getListenerCount() > 0) { List<IChemObjectListener> listeners = lazyChemObjectListeners(); for (Object listener : listeners) { ((IChemObjectListener) listener).stateChanged(evt); } } } /** * Lazy creation of properties hash. * * @return Returns in instance of the properties */ private Map<Object, Object> lazyProperties() { if (properties == null) { properties = new HashMap<Object, Object>(); } return properties; } /** * Sets a property for a IChemObject. * *@param description An object description of the property (most likely a * unique string) *@param property An object with the property itself *@see #getProperty *@see #removeProperty */ public void setProperty(Object description, Object property) { lazyProperties().put(description, property); notifyChanged(); } /** * Removes a property for a IChemObject. * *@param description The object description of the property (most likely a * unique string) *@see #setProperty *@see #getProperty */ public void removeProperty(Object description) { if (properties == null) { return; } lazyProperties().remove(description); } /** * Returns a property for the IChemObject. * *@param description An object description of the property (most likely a * unique string) *@return The object containing the property. Returns null if * propert is not set. *@see #setProperty *@see #removeProperty */ public Object getProperty(Object description) { if (properties != null) { return lazyProperties().get(description); } return null; } /** * Returns a Map with the IChemObject's properties. * *@return The object's properties as an Hashtable *@see #setProperties */ public Map<Object,Object> getProperties() { return lazyProperties(); } /** * Clones this <code>IChemObject</code>. It clones the identifier, flags, * properties and pointer vectors. The ChemObjectListeners are not cloned, and * neither is the content of the pointer vectors. * *@return The cloned object */ public Object clone() throws CloneNotSupportedException { ChemObject clone = (ChemObject)super.clone(); // clone the flags clone.flags = new boolean[CDKConstants.MAX_FLAG_INDEX + 1]; System.arraycopy(flags, 0, clone.flags, 0, flags.length); // clone the properties if (properties != null) { Map<Object, Object> clonedHashtable = new HashMap<Object, Object>(); Iterator<Object> keys = properties.keySet().iterator(); while (keys.hasNext()) { Object key = keys.next(); Object value = properties.get(key); clonedHashtable.put(key, value); } clone.properties = clonedHashtable; } // delete all listeners clone.chemObjectListeners = null; return clone; } /** * Compares a IChemObject with this IChemObject. * *@param object Object of type AtomType *@return true if the atom types are equal */ public boolean compare(Object object) { if (!(object instanceof IChemObject)) { return false; } ChemObject chemObj = (ChemObject) object; return identifier == chemObj.identifier; } /** * Returns the identifier (ID) of this object. * *@return a String representing the ID value *@see #setID */ public String getID() { return this.identifier; } /** * Sets the identifier (ID) of this object. * *@param identifier a String representing the ID value *@see #getID */ public void setID(String identifier) { this.identifier = identifier; notifyChanged(); } /** * Sets the value of some flag. * *@param flag_type Flag to set *@param flag_value Value to assign to flag *@see #getFlag */ public void setFlag(int flag_type, boolean flag_value) { flags[flag_type] = flag_value; notifyChanged(); } /** * Returns the value of some flag. * *@param flag_type Flag to retrieve the value of *@return true if the flag <code>flag_type</code> is set *@see #setFlag */ public boolean getFlag(int flag_type) { return flags[flag_type]; } /** * Sets the properties of this object. * *@param properties a Hashtable specifying the property values *@see #getProperties */ public void setProperties(Map<Object,Object> properties) { Iterator<Object> keys = properties.keySet().iterator(); while (keys.hasNext()) { Object key = keys.next(); lazyProperties().put(key, properties.get(key)); } notifyChanged(); } /** * Sets the whole set of flags. * * @param flagsNew the new flags. * @see #getFlags */ public void setFlags(boolean[] flagsNew){ flags=flagsNew; } /** * Returns the whole set of flags. * *@return the flags. *@see #setFlags */ public boolean[] getFlags(){ return(flags); } /** * Clones this <code>IChemObject</code>, but preserves references to <code>Object</code>s. * * @return Shallow copy of this IChemObject * @see #clone */ public Object shallowCopy() { Object copy = null; try { copy = super.clone(); } catch (Exception e) { e.printStackTrace(System.err); } return copy; } public IChemObjectBuilder getBuilder() { return DefaultChemObjectBuilder.getInstance(); } private boolean doNotification = true; public void setNotification(boolean bool) { this.doNotification = bool; } public boolean getNotification() { return this.doNotification; } }