SpectralMatch

class pyopenms.SpectralMatch

Bases: object

Cython implementation of _SpectralMatch

Documentation is available at http://www.openms.de/current_doxygen/html/classOpenMS_1_1SpectralMatch.html

__init__()

Cython signature: void SpectralMatch()
Cython signature: void SpectralMatch(SpectralMatch &)

Methods

`__init__`	Cython signature: void SpectralMatch()
`getCommonName`	Cython signature: String getCommonName()
`getFoundPrecursorCharge`	Cython signature: int getFoundPrecursorCharge()
`getFoundPrecursorMass`	Cython signature: double getFoundPrecursorMass()
`getInchiString`	Cython signature: String getInchiString()
`getMatchingScore`	Cython signature: double getMatchingScore()
`getMatchingSpectrumIndex`	Cython signature: size_t getMatchingSpectrumIndex()
`getObservedPrecursorMass`	Cython signature: double getObservedPrecursorMass()
`getObservedPrecursorRT`	Cython signature: double getObservedPrecursorRT()
`getObservedSpectrumIndex`	Cython signature: size_t getObservedSpectrumIndex()
`getPrecursorAdduct`	Cython signature: String getPrecursorAdduct()
`getPrimaryIdentifier`	Cython signature: String getPrimaryIdentifier()
`getSMILESString`	Cython signature: String getSMILESString()
`getSecondaryIdentifier`	Cython signature: String getSecondaryIdentifier()
`getSumFormula`	Cython signature: String getSumFormula()
`setCommonName`	Cython signature: void setCommonName(String)
`setFoundPrecursorCharge`	Cython signature: void setFoundPrecursorCharge(int)
`setFoundPrecursorMass`	Cython signature: void setFoundPrecursorMass(double)
`setInchiString`	Cython signature: void setInchiString(String)
`setMatchingScore`	Cython signature: void setMatchingScore(double)
`setMatchingSpectrumIndex`	Cython signature: void setMatchingSpectrumIndex(size_t)
`setObservedPrecursorMass`	Cython signature: void setObservedPrecursorMass(double)
`setObservedPrecursorRT`	Cython signature: void setObservedPrecursorRT(double)
`setObservedSpectrumIndex`	Cython signature: void setObservedSpectrumIndex(size_t)
`setPrecursorAdduct`	Cython signature: void setPrecursorAdduct(String)
`setPrimaryIdentifier`	Cython signature: void setPrimaryIdentifier(String)
`setSMILESString`	Cython signature: void setSMILESString(String)
`setSecondaryIdentifier`	Cython signature: void setSecondaryIdentifier(String)
`setSumFormula`	Cython signature: void setSumFormula(String)

getCommonName(): Cython signature: String getCommonName()

getFoundPrecursorCharge(): Cython signature: int getFoundPrecursorCharge()

getFoundPrecursorMass(): Cython signature: double getFoundPrecursorMass()

getInchiString(): Cython signature: String getInchiString()

getMatchingScore(): Cython signature: double getMatchingScore()

getMatchingSpectrumIndex(): Cython signature: size_t getMatchingSpectrumIndex()

getObservedPrecursorMass(): Cython signature: double getObservedPrecursorMass()

getObservedPrecursorRT(): Cython signature: double getObservedPrecursorRT()

getObservedSpectrumIndex(): Cython signature: size_t getObservedSpectrumIndex()

getPrecursorAdduct(): Cython signature: String getPrecursorAdduct()

getPrimaryIdentifier(): Cython signature: String getPrimaryIdentifier()

getSMILESString(): Cython signature: String getSMILESString()

getSecondaryIdentifier(): Cython signature: String getSecondaryIdentifier()

getSumFormula(): Cython signature: String getSumFormula()

setCommonName(): Cython signature: void setCommonName(String)

setFoundPrecursorCharge(): Cython signature: void setFoundPrecursorCharge(int)

setFoundPrecursorMass(): Cython signature: void setFoundPrecursorMass(double)

setInchiString(): Cython signature: void setInchiString(String)

setMatchingScore(): Cython signature: void setMatchingScore(double)

setMatchingSpectrumIndex(): Cython signature: void setMatchingSpectrumIndex(size_t)

setObservedPrecursorMass(): Cython signature: void setObservedPrecursorMass(double)

setObservedPrecursorRT(): Cython signature: void setObservedPrecursorRT(double)

setObservedSpectrumIndex(): Cython signature: void setObservedSpectrumIndex(size_t)

setPrecursorAdduct(): Cython signature: void setPrecursorAdduct(String)

setPrimaryIdentifier(): Cython signature: void setPrimaryIdentifier(String)

setSMILESString(): Cython signature: void setSMILESString(String)

setSecondaryIdentifier(): Cython signature: void setSecondaryIdentifier(String)

setSumFormula(): Cython signature: void setSumFormula(String)