From: <eg...@us...> - 2007-11-04 21:20:05
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Revision: 9365 http://cdk.svn.sourceforge.net/cdk/?rev=9365&view=rev Author: egonw Date: 2007-11-04 13:19:36 -0800 (Sun, 04 Nov 2007) Log Message: ----------- Fixed count of ring electrons for S.planar3 Modified Paths: -------------- trunk/cdk/src/org/openscience/cdk/aromaticity/CDKHueckelAromaticityDetector.java Modified: trunk/cdk/src/org/openscience/cdk/aromaticity/CDKHueckelAromaticityDetector.java =================================================================== --- trunk/cdk/src/org/openscience/cdk/aromaticity/CDKHueckelAromaticityDetector.java 2007-11-04 21:19:18 UTC (rev 9364) +++ trunk/cdk/src/org/openscience/cdk/aromaticity/CDKHueckelAromaticityDetector.java 2007-11-04 21:19:36 UTC (rev 9365) @@ -129,6 +129,8 @@ electronCount += 2; } else if ("S.2".equals(ringAtom.getAtomTypeName())) { electronCount += 2; + } else if ("S.planar3".equals(ringAtom.getAtomTypeName())) { + electronCount += 2; } else if ("O.planar3".equals(ringAtom.getAtomTypeName())) { electronCount += 2; } else { This was sent by the SourceForge.net collaborative development platform, the world's largest Open Source development site. |