Class ResultFracDimCalc
- java.lang.Object
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- com.actelion.research.util.datamodel.IdentifiedObject<StereoMolecule>
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- com.actelion.research.chem.properties.fractaldimension.InputObjectFracDimCalc
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- com.actelion.research.chem.properties.fractaldimension.ResultFracDimCalc
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- All Implemented Interfaces:
IIdentifiedObject<StereoMolecule>
,java.lang.Comparable<IdentifiedObject<StereoMolecule>>
public class ResultFracDimCalc extends InputObjectFracDimCalc
ResultFracDimCalcModest v. Korff
Created by korffmo1 on 28.08.18.
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Field Summary
Fields Modifier and Type Field Description static java.lang.String[]
ARR_TAGS
static java.lang.String
SEP
static java.lang.String
TAG_BONDS_AT_MAX_FRAGS_CALC
static java.lang.String
TAG_FRACTAL_DIM
static java.lang.String
TAG_ID
static java.lang.String
TAG_MAX_NUM_UNIQUE_FRAGMENTS_CALC
static java.lang.String
TAG_MESSAGE
static java.lang.String
TAG_SMILES
static java.lang.String
TAG_SUM_UNIQUE_FRAGMENTS_CALC
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Constructor Summary
Constructors Constructor Description ResultFracDimCalc(InputObjectFracDimCalc inputObjectFracDimCalc)
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Method Summary
All Methods Static Methods Instance Methods Concrete Methods Modifier and Type Method Description int
getBondsAtMaxFrag()
double
getFractalDimension()
int
getMaxNumUniqueFrags()
java.lang.String
getMessage()
int
getSumUniqueFrags()
java.lang.String
toString()
static java.lang.String
toStringHeader()
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Methods inherited from class com.actelion.research.chem.properties.fractaldimension.InputObjectFracDimCalc
getSmiles
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Methods inherited from class com.actelion.research.util.datamodel.IdentifiedObject
compareTo, getComparatorId, getData, getHashMap, getId, setData, setId, shuffleArray
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Field Detail
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TAG_SMILES
public static final java.lang.String TAG_SMILES
- See Also:
- Constant Field Values
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TAG_ID
public static final java.lang.String TAG_ID
- See Also:
- Constant Field Values
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TAG_SUM_UNIQUE_FRAGMENTS_CALC
public static final java.lang.String TAG_SUM_UNIQUE_FRAGMENTS_CALC
- See Also:
- Constant Field Values
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TAG_BONDS_AT_MAX_FRAGS_CALC
public static final java.lang.String TAG_BONDS_AT_MAX_FRAGS_CALC
- See Also:
- Constant Field Values
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TAG_MAX_NUM_UNIQUE_FRAGMENTS_CALC
public static final java.lang.String TAG_MAX_NUM_UNIQUE_FRAGMENTS_CALC
- See Also:
- Constant Field Values
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TAG_FRACTAL_DIM
public static final java.lang.String TAG_FRACTAL_DIM
- See Also:
- Constant Field Values
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TAG_MESSAGE
public static final java.lang.String TAG_MESSAGE
- See Also:
- Constant Field Values
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ARR_TAGS
public static final java.lang.String[] ARR_TAGS
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SEP
public static final java.lang.String SEP
- See Also:
- Constant Field Values
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Constructor Detail
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ResultFracDimCalc
public ResultFracDimCalc(InputObjectFracDimCalc inputObjectFracDimCalc)
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Method Detail
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getFractalDimension
public double getFractalDimension()
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getBondsAtMaxFrag
public int getBondsAtMaxFrag()
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getMaxNumUniqueFrags
public int getMaxNumUniqueFrags()
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getSumUniqueFrags
public int getSumUniqueFrags()
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getMessage
public java.lang.String getMessage()
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toString
public java.lang.String toString()
- Overrides:
toString
in classIdentifiedObject<StereoMolecule>
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toStringHeader
public static java.lang.String toStringHeader()
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