Package com.actelion.research.chem.properties.complexity

Class ResultFragmentsStatistic

java.lang.Object

com.actelion.research.chem.properties.complexity.ResultFragmentsStatistic

public class ResultFragmentsStatistic
extends java.lang.Object

Field Summary

Fields

Modifier and Type	Field	Description
static java.lang.String	TAG_ResultFragmentsStatistic

Constructor Summary

Constructors

Constructor	Description
ResultFragmentsStatistic(StereoMolecule mol, java.util.List<ModelExhaustiveStatistics> liModelExhaustiveStatistics)

Method Summary

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()

Methods inherited from class java.lang.Object

clone, equals, finalize, getClass, hashCode, notify, notifyAll, wait, wait, wait

Field Detail

TAG_ResultFragmentsStatistic

public static final java.lang.String TAG_ResultFragmentsStatistic

See Also:

Constant Field Values

Constructor Detail

ResultFragmentsStatistic

public ResultFragmentsStatistic(StereoMolecule mol,
                                java.util.List<ModelExhaustiveStatistics> liModelExhaustiveStatistics)

Parameters:

liModelExhaustiveStatistics -

Method Detail

getAtoms

public int getAtoms()

Returns:

the nAtomsMolecule

getBonds

public int getBonds()

Returns:

the nBondsMolecule

getExhaustiveStatistics

public java.util.List<ModelExhaustiveStatistics> getExhaustiveStatistics()

Returns:

the liModelExhaustiveStatistics

getName

public java.lang.String getName()

Returns:

the name

setName

public void setName(java.lang.String name)

Parameters:

name - the name to set

toString

public java.lang.String toString()

Overrides:

toString in class java.lang.Object

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

getMol

public StereoMolecule getMol()

Returns:

the mol

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