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insert SMILES, any [C@H], clean up --> NPE

Open rwst opened this issue 13 years ago • 0 comments

depends on https://sourceforge.net/p/cdk/bugs/1269/

java.lang.NullPointerException at javax.vecmath.Tuple2d.(Tuple2d.java:82) at javax.vecmath.Vector2d.(Vector2d.java:86) at org.openscience.cdk.layout.AtomPlacer.distributePartners(AtomPlacer.java:163) at org.openscience.cdk.layout.HydrogenPlacer.placeHydrogens2D(HydrogenPlacer.java:112) at org.openscience.cdk.layout.HydrogenPlacer.placeHydrogens2D(HydrogenPlacer.java:68) at org.openscience.cdk.layout.StructureDiagramGenerator.generateExperimentalCoordinates(StructureDiagramGenerator.java:280) at org.openscience.cdk.layout.StructureDiagramGenerator.generateExperimentalCoordinates(StructureDiagramGenerator.java:248) at org.openscience.jchempaint.controller.ControllerHub.generateNewCoordinates(ControllerHub.java:1266) at org.openscience.jchempaint.controller.ControllerHub.cleanup(ControllerHub.java:1227) at org.openscience.jchempaint.action.CleanupAction.actionPerformed(CleanupAction.java:61)

rwst avatar Oct 27 '12 15:10 rwst