AMSE_AdductInfo

class pyopenms.AMSE_AdductInfo

Bases: object

Cython implementation of _AMSE_AdductInfo

Original C++ documentation is available here

__init__(self, name: bytes | str | String, adduct: EmpiricalFormula, charge: int, mol_multiplier: int) → None

Methods

__init__(self, name, adduct, charge, ...)
getCharge(self)
getMZ(self, neutral_mass)
getName(self)
getNeutralMass(self, observed_mz)
isCompatible(self, db_entry)

getCharge(self) → int

getMZ(self, neutral_mass: float) → float

getName(self) → bytes | str | String

getNeutralMass(self, observed_mz: float) → float

isCompatible(self, db_entry: EmpiricalFormula) → bool