[Cdk-commits] SF.net SVN: cdk:[14017] cdk/trunk/src/main/org/openscience/cdk/charges/ StabilizationCharges.java

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

Revision: 14017
          http://cdk.svn.sourceforge.net/cdk/?rev=14017&view=rev
Author:   egonw
Date:     2009-01-30 17:23:29 +0000 (Fri, 30 Jan 2009)

Log Message:
-----------
removed "throws CDKException" from method StructureResonanceGenerator.setReactions(List<IReactionProcess> newReactionsList). And depending methods as StabilizationCharges.calculatePositive. It was producing some incoherences: org.openscience.cdk.charges.StabilizationCharges row 83: Unreachable catch block for CDKException. This exception is never thrown from the try statement body.

git-svn-id:
 https://cdk.svn.sourceforge.net/svnroot/cdk/cdk/trunk@12339 eb4e18e3-b210-0410-a6ab-dec725e4b171

Author:    miguelrojasch <miguelrojasch@eb4e18e3-b210-0410-a6ab-dec725e4b171>

Modified Paths:
--------------
    cdk/trunk/src/main/org/openscience/cdk/charges/StabilizationCharges.java

Modified: cdk/trunk/src/main/org/openscience/cdk/charges/StabilizationCharges.java
===================================================================
--- cdk/trunk/src/main/org/openscience/cdk/charges/StabilizationCharges.java	2009-01-30 17:22:33 UTC (rev 14016)
+++ cdk/trunk/src/main/org/openscience/cdk/charges/StabilizationCharges.java	2009-01-30 17:23:29 UTC (rev 14017)
@@ -76,14 +76,10 @@
 
     	// only must be generated all structures which stabilize the atom in question.
     	StructureResonanceGenerator gRI = new StructureResonanceGenerator();
-    	try {
-    		List<IReactionProcess> reactionList = gRI.getReactions();
-    		reactionList.add(new HyperconjugationReaction());
-    		gRI.setReactions(reactionList);
-		} catch (CDKException e) {
-			e.printStackTrace();
-		}
-    	IAtomContainerSet resonanceS = gRI.getStructures((IMolecule) atomContainer);
+    	List<IReactionProcess> reactionList = gRI.getReactions();
+    	reactionList.add(new HyperconjugationReaction());
+    	gRI.setReactions(reactionList);
+		IAtomContainerSet resonanceS = gRI.getStructures((IMolecule) atomContainer);
     	IAtomContainerSet containerS = gRI.getContainers((IMolecule) atomContainer);
     	if(resonanceS.getAtomContainerCount() < 2)// meaning it was not find any resonance structure
 			return 0.0;


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