Class DruglikenessPredictor
- java.lang.Object
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- com.actelion.research.chem.prediction.DruglikenessPredictor
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public class DruglikenessPredictor extends java.lang.Object
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Field Summary
Fields Modifier and Type Field Description static double
cDruglikenessUnknown
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Constructor Summary
Constructors Constructor Description DruglikenessPredictor()
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Method Summary
All Methods Instance Methods Concrete Methods Modifier and Type Method Description double
assessDruglikeness(StereoMolecule testMolecule, ThreadMaster threadMaster)
ParameterizedStringList
getDetail()
If assessDruglikeness() was called multiple times in multiple threads, then getDetail() won't retrieve the expected detail.java.lang.String
getDruglikenessString(StereoMolecule testMolecule)
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Field Detail
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cDruglikenessUnknown
public static final double cDruglikenessUnknown
- See Also:
- Constant Field Values
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Method Detail
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assessDruglikeness
public double assessDruglikeness(StereoMolecule testMolecule, ThreadMaster threadMaster)
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getDruglikenessString
public java.lang.String getDruglikenessString(StereoMolecule testMolecule)
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getDetail
public ParameterizedStringList getDetail()
If assessDruglikeness() was called multiple times in multiple threads, then getDetail() won't retrieve the expected detail.- Returns:
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