[Cdk-commits] CVS: cdk/src/org/openscience/cdk/qsar DescriptorEngine.java,1.15,1.16

[Egon W. <eg...@us...>]

Update of /cvsroot/cdk/cdk/src/org/openscience/cdk/qsar
In directory sc8-pr-cvs1.sourceforge.net:/tmp/cvs-serv28201/src/org/openscience/cdk/qsar

Modified Files:
	DescriptorEngine.java 
Log Message:
Matched Descriptor: use AtomContainer instead of Molecule.

Index: DescriptorEngine.java
===================================================================
RCS file: /cvsroot/cdk/cdk/src/org/openscience/cdk/qsar/DescriptorEngine.java,v
retrieving revision 1.15
retrieving revision 1.16
diff -u -r1.15 -r1.16
--- DescriptorEngine.java	16 Sep 2005 13:46:05 -0000	1.15
+++ DescriptorEngine.java	25 Sep 2005 19:18:18 -0000	1.16
@@ -30,6 +30,7 @@
 import java.util.List;
 import java.util.Vector;
 
+import org.openscience.cdk.interfaces.AtomContainer;
 import org.openscience.cdk.dict.DictionaryDatabase;
 import org.openscience.cdk.dict.Entry;
 import org.openscience.cdk.exception.CDKException;
@@ -226,7 +227,7 @@
      * @param  molecule  The molecule for which we want to calculate descriptors   
      * @throws CDKException if an error occured during descriptor calculation
      */
-    public void process(org.openscience.cdk.interfaces.Molecule molecule) throws CDKException {
+    public void process(AtomContainer molecule) throws CDKException {
         for (int i = 0; i < descriptors.size(); i++) {    
             Descriptor descriptor = (Descriptor)descriptors.get(i);
             try {