Class ResultFragmentsStatistic
- java.lang.Object
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- com.actelion.research.chem.properties.complexity.ResultFragmentsStatistic
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public class ResultFragmentsStatistic extends java.lang.Object
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Field Summary
Fields Modifier and Type Field Description static java.lang.String
TAG_ResultFragmentsStatistic
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Constructor Summary
Constructors Constructor Description ResultFragmentsStatistic(StereoMolecule mol, java.util.List<ModelExhaustiveStatistics> liModelExhaustiveStatistics)
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Method Summary
All Methods Static Methods Instance Methods Concrete Methods Modifier and Type Method Description int
getAtoms()
int
getBonds()
java.util.List<ModelExhaustiveStatistics>
getExhaustiveStatistics()
StereoMolecule
getMol()
java.lang.String
getName()
org.w3c.dom.Element
getXMLElement(org.w3c.dom.Document doc)
static ResultFragmentsStatistic
readXMLElement(org.w3c.dom.Element root)
void
setName(java.lang.String name)
java.lang.String
toString()
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Field Detail
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TAG_ResultFragmentsStatistic
public static final java.lang.String TAG_ResultFragmentsStatistic
- See Also:
- Constant Field Values
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Constructor Detail
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ResultFragmentsStatistic
public ResultFragmentsStatistic(StereoMolecule mol, java.util.List<ModelExhaustiveStatistics> liModelExhaustiveStatistics)
- Parameters:
liModelExhaustiveStatistics
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Method Detail
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getAtoms
public int getAtoms()
- Returns:
- the nAtomsMolecule
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getBonds
public int getBonds()
- Returns:
- the nBondsMolecule
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getExhaustiveStatistics
public java.util.List<ModelExhaustiveStatistics> getExhaustiveStatistics()
- Returns:
- the liModelExhaustiveStatistics
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getName
public java.lang.String getName()
- Returns:
- the name
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setName
public void setName(java.lang.String name)
- Parameters:
name
- the name to set
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toString
public java.lang.String toString()
- Overrides:
toString
in classjava.lang.Object
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getXMLElement
public org.w3c.dom.Element getXMLElement(org.w3c.dom.Document doc) throws javax.xml.parsers.ParserConfigurationException, org.w3c.dom.DOMException, java.io.IOException
- Throws:
javax.xml.parsers.ParserConfigurationException
org.w3c.dom.DOMException
java.io.IOException
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getMol
public StereoMolecule getMol()
- Returns:
- the mol
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readXMLElement
public static ResultFragmentsStatistic readXMLElement(org.w3c.dom.Element root) throws javax.xml.parsers.ParserConfigurationException, org.w3c.dom.DOMException, java.io.IOException
- Throws:
javax.xml.parsers.ParserConfigurationException
org.w3c.dom.DOMException
java.io.IOException
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