Package | Description |
---|---|
org.openscience.cdk | |
org.openscience.cdk.debug | |
org.openscience.cdk.qsar.descriptors.substance |
Modifier and Type | Class and Description |
---|---|
class |
Substance
An implementation of the
ISubstance interface. |
Modifier and Type | Class and Description |
---|---|
class |
DebugSubstance
Debugging data class.
|
Modifier and Type | Method and Description |
---|---|
DescriptorValue |
OxygenAtomCountDescriptor.calculate(ISubstance substance)
Calculates the descriptor value for the given
ISubstance . |
DescriptorValue |
ISubstanceDescriptor.calculate(ISubstance substance)
Calculates the descriptor value for the given
ISubstance . |
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