SpectralMatch

class pyopenms.SpectralMatch

Bases: object

Cython implementation of _SpectralMatch

Original C++ documentation is available here

__init__()

Overload:

__init__(self) → None

Overload:

__init__(self, in_0: SpectralMatch) → None

Methods

`__init__`	Overload:
`getCommonName`(self)
`getFoundPrecursorCharge`(self)
`getFoundPrecursorMass`(self)
`getInchiString`(self)
`getMatchingScore`(self)
`getMatchingSpectrumIndex`(self)
`getObservedPrecursorMass`(self)
`getObservedPrecursorRT`(self)
`getObservedSpectrumIndex`(self)
`getPrecursorAdduct`(self)
`getPrimaryIdentifier`(self)
`getSMILESString`(self)
`getSecondaryIdentifier`(self)
`getSumFormula`(self)
`setCommonName`(self, in_0)
`setFoundPrecursorCharge`(self, in_0)
`setFoundPrecursorMass`(self, in_0)
`setInchiString`(self, in_0)
`setMatchingScore`(self, in_0)
`setMatchingSpectrumIndex`(self, in_0)
`setObservedPrecursorMass`(self, in_0)
`setObservedPrecursorRT`(self, in_0)
`setObservedSpectrumIndex`(self, in_0)
`setPrecursorAdduct`(self, in_0)
`setPrimaryIdentifier`(self, in_0)
`setSMILESString`(self, in_0)
`setSecondaryIdentifier`(self, in_0)
`setSumFormula`(self, in_0)

getCommonName(self) → Union[bytes, str, String]

getFoundPrecursorCharge(self) → int

getFoundPrecursorMass(self) → float

getInchiString(self) → Union[bytes, str, String]

getMatchingScore(self) → float

getMatchingSpectrumIndex(self) → int

getObservedPrecursorMass(self) → float

getObservedPrecursorRT(self) → float

getObservedSpectrumIndex(self) → int

getPrecursorAdduct(self) → Union[bytes, str, String]

getPrimaryIdentifier(self) → Union[bytes, str, String]

getSMILESString(self) → Union[bytes, str, String]

getSecondaryIdentifier(self) → Union[bytes, str, String]

getSumFormula(self) → Union[bytes, str, String]

setCommonName(self, in_0: Union[bytes, str, String]) → None

setFoundPrecursorCharge(self, in_0: int) → None

setFoundPrecursorMass(self, in_0: float) → None

setInchiString(self, in_0: Union[bytes, str, String]) → None

setMatchingScore(self, in_0: float) → None

setMatchingSpectrumIndex(self, in_0: int) → None

setObservedPrecursorMass(self, in_0: float) → None

setObservedPrecursorRT(self, in_0: float) → None

setObservedSpectrumIndex(self, in_0: int) → None

setPrecursorAdduct(self, in_0: Union[bytes, str, String]) → None

setPrimaryIdentifier(self, in_0: Union[bytes, str, String]) → None

setSMILESString(self, in_0: Union[bytes, str, String]) → None

setSecondaryIdentifier(self, in_0: Union[bytes, str, String]) → None

setSumFormula(self, in_0: Union[bytes, str, String]) → None