#500 Autocorrelation descriptor is not validated

open
5
2012-10-08
2007-05-31
Egon Willighagen
No

Testcase: testcalculate_IAtomContainer(org.openscience.cdk.test.qsar.descriptors.molecular.AutocorrelationDescriptorChargeTest): FAILED
Not validated yet
junit.framework.AssertionFailedError: Not validated yet
at org.openscience.cdk.test.qsar.descriptors.molecular.AutocorrelationDescriptorChargeTest.testcalculate_IAtomContainer(AutocorrelationDescriptorChargeTest.java:38)
at sun.reflect.NativeMethodAccessorImpl.invoke0(Native Method)
at sun.reflect.NativeMethodAccessorImpl.invoke(NativeMethodAccessorImpl.java:39)
at sun.reflect.DelegatingMethodAccessorImpl.invoke(DelegatingMethodAccessorImpl.java:25)

Testcase: testcalculate_IAtomContainer(org.openscience.cdk.test.qsar.descriptors.molecular.AutocorrelationDescriptorMassTest): FAILED
Not validated yet
junit.framework.AssertionFailedError: Not validated yet
at org.openscience.cdk.test.qsar.descriptors.molecular.AutocorrelationDescriptorMassTest.testcalculate_IAtomContainer(AutocorrelationDescriptorMassTest.java:57)
at sun.reflect.NativeMethodAccessorImpl.invoke0(Native Method)
at sun.reflect.NativeMethodAccessorImpl.invoke(NativeMethodAccessorImpl.java:39)
at sun.reflect.DelegatingMethodAccessorImpl.invoke(DelegatingMethodAccessorImpl.java:25)

Testcase: testcalculate_IAtomContainer(org.openscience.cdk.test.qsar.descriptors.molecular.AutocorrelationDescriptorPolarizabilityTest): FAILED
Not validated yet
junit.framework.AssertionFailedError: Not validated yet
at org.openscience.cdk.test.qsar.descriptors.molecular.AutocorrelationDescriptorPolarizabilityTest.testcalculate_IAtomContainer(AutocorrelationDescriptorPolarizabilityTest.java:39)
at sun.reflect.NativeMethodAccessorImpl.invoke0(Native Method)
at sun.reflect.NativeMethodAccessorImpl.invoke(NativeMethodAccessorImpl.java:39)
at sun.reflect.DelegatingMethodAccessorImpl.invoke(DelegatingMethodAccessorImpl.java:25)

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