Class DescriptorHandlerLongCFP
- java.lang.Object
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- com.actelion.research.chem.descriptor.AbstractDescriptorHandlerLongFP<StereoMolecule>
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- com.actelion.research.chem.descriptor.DescriptorHandlerLongCFP
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- All Implemented Interfaces:
DescriptorHandler<long[],StereoMolecule>
,ISimilarityCalculator<long[]>
public class DescriptorHandlerLongCFP extends AbstractDescriptorHandlerLongFP<StereoMolecule>
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Field Summary
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Fields inherited from class com.actelion.research.chem.descriptor.AbstractDescriptorHandlerLongFP
FAILED_OBJECT
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Fields inherited from interface com.actelion.research.chem.descriptor.DescriptorHandler
FAILED_BYTES, FAILED_STRING
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Constructor Summary
Constructors Constructor Description DescriptorHandlerLongCFP()
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Method Summary
All Methods Static Methods Instance Methods Concrete Methods Modifier and Type Method Description long[]
createDescriptor(StereoMolecule mol)
This descriptor requires proper up/down bonds, because it encodes stereo parities.static DescriptorHandlerLongCFP
getDefaultInstance()
DescriptorInfo
getInfo()
float
getSimilarity(long[] o1, long[] o2)
DescriptorHandler<long[],StereoMolecule>
getThreadSafeCopy()
java.lang.String
getVersion()
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Methods inherited from class com.actelion.research.chem.descriptor.AbstractDescriptorHandlerLongFP
calculationFailed, decode, decode, encode
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Method Detail
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getDefaultInstance
public static DescriptorHandlerLongCFP getDefaultInstance()
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getInfo
public DescriptorInfo getInfo()
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getVersion
public java.lang.String getVersion()
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createDescriptor
public long[] createDescriptor(StereoMolecule mol)
This descriptor requires proper up/down bonds, because it encodes stereo parities. If a passed molecule is generated from idcode parsing, make sure that coordinates and up/down/bonds are available, i.e. that the IDCodeParser was instantiated with the respective option.
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getSimilarity
public float getSimilarity(long[] o1, long[] o2)
- Specified by:
getSimilarity
in interfaceISimilarityCalculator<long[]>
- Overrides:
getSimilarity
in classAbstractDescriptorHandlerLongFP<StereoMolecule>
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getThreadSafeCopy
public DescriptorHandler<long[],StereoMolecule> getThreadSafeCopy()
- Returns:
- a deep copy for parallel computing.
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