maltcms.datastructures.ms
Interface IMetabolite

All Superinterfaces:

Comparable<IAnchor>, IAnchor, IRetentionInfo

All Known Implementing Classes:

Metabolite, Metabolite2D

public interface IMetabolite
extends IRetentionInfo

Interface representing a Metabolite.

Author:

Nils.Hoffmann@cebitec.uni-bielefeld.de

Method Summary

String	getComments()
String	getDate()
String	getFormula()
String	getID()
cross.datastructures.tuple.Tuple2D<ArrayDouble.D1,ArrayInt.D1>	getMassSpectrum()
double	getMaxIntensity()
double	getMaxMass()
double	getMinIntensity()
double	getMinMass()
double	getMw()
int	getMW()
String	getShortName()
String	getSP()
void	setComments(String comments)
void	setDate(String date)
void	setFormula(String formula)
void	setID(String id)
void	setMassSpectrum(ArrayDouble.D1 masses, ArrayInt.D1 intensities)
void	setMaxIntensity(double intens)
void	setMaxMass(double m)
void	setMinIntensity(double intens)
void	setMinMass(double m)
void	setMw(double mw)
void	setMW(int mw)
void	setShortName(String sname)
void	setSP(String sp)
void	update(IMetabolite m)

Methods inherited from interface maltcms.datastructures.ms.IRetentionInfo

getRetentionIndex, getRetentionTime, getRetentionTimeUnit, setRetentionIndex, setRetentionTime, setRetentionTimeUnit

Methods inherited from interface maltcms.datastructures.ms.IAnchor

getName, getScanIndex, setName, setScanIndex

Methods inherited from interface java.lang.Comparable

compareTo

Method Detail

getComments

String getComments()

getDate

String getDate()

getFormula

String getFormula()

getID

String getID()

getMassSpectrum

cross.datastructures.tuple.Tuple2D<ArrayDouble.D1,ArrayInt.D1> getMassSpectrum()

getMaxIntensity

double getMaxIntensity()

getMaxMass

double getMaxMass()

getMinIntensity

double getMinIntensity()

getMinMass

double getMinMass()

getMW

int getMW()

getMw

double getMw()

getShortName

String getShortName()

getSP

String getSP()

setComments

void setComments(String comments)

setDate

void setDate(String date)

setFormula

void setFormula(String formula)

setID

void setID(String id)

setMassSpectrum

void setMassSpectrum(ArrayDouble.D1 masses,
                     ArrayInt.D1 intensities)

setMaxIntensity

void setMaxIntensity(double intens)

setMaxMass

void setMaxMass(double m)

setMinIntensity

void setMinIntensity(double intens)

setMinMass

void setMinMass(double m)

setMW

void setMW(int mw)

setMw

void setMw(double mw)

setShortName

void setShortName(String sname)

setSP

void setSP(String sp)

update

void update(IMetabolite m)