When I try to instanciate a new descriptor engine:
DescriptorEngine cdkEngine = new
DescriptorEngine(DescriptorEngine.MOLECULAR) ;
I get the following exception:
run:
Exception in thread "AWT-EventQueue-0" java.lang.NoSuchFieldError:
valencesTable
at
org.openscience.cdk.qsar.descriptors.molecular.ValenceCarbonConnectivityOrderOneDescriptor.<init>(ValenceCarbonConnectivityOrderOneDescriptor.java:88)
at
sun.reflect.NativeConstructorAccessorImpl.newInstance0(Native Method)
at
sun.reflect.NativeConstructorAccessorImpl.newInstance(NativeConstructorAccessorImpl.java:39)
at
sun.reflect.DelegatingConstructorAccessorImpl.newInstance(DelegatingConstructorAccessorImpl.java:27)
at java.lang.reflect.Constructor.newInstance(Constructor.java:513)
at java.lang.Class.newInstance0(Class.java:355)
at java.lang.Class.newInstance(Class.java:308)
at
org.openscience.cdk.qsar.DescriptorEngine.instantiateDescriptors(DescriptorEngine.java:678)
at
org.openscience.cdk.qsar.DescriptorEngine.<init>(DescriptorEngine.java:163)
at
org.openscience.cdk.qsar.DescriptorEngine.<init>(DescriptorEngine.java:134)
at myline (...)
Don't know if I've missed something or if it's an actual bug... :) (oh
I'm using the lastest version of the CDK, 2009.03.13)
--
Vincent Le Guilloux
Phd Student - ICOA - UMR CNRS 6005
Div. of chemoinformatic and molecular modeling.
University of Orléans
Phone: ++33 2 38 49 45 77
Fax : ++33 2 38 41 72 81
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