35 #ifndef OPENMS_TRANSFORMATIONS_FEATUREFINDER_MULTIPLEXPEAKPATTERN_H
36 #define OPENMS_TRANSFORMATIONS_FEATUREFINDER_MULTIPLEXPEAKPATTERN_H
66 int getCharge()
const;
71 int getPeaksPerPeptide()
const;
76 std::vector<double> getMassShifts()
const;
81 int getMassShiftIndex()
const;
86 unsigned getMassShiftCount()
const;
91 double getMassShiftAt(
int i)
const;
96 double getMZShiftAt(
int i)
const;
101 unsigned getMZShiftCount()
const;
std::vector< double > mass_shifts_
mass shifts between peptides (including zero mass shift for first peptide)
Definition: MultiplexPeakPattern.h:125
Definition: MSNumpress.h:66
Main OpenMS namespace.
Definition: FeatureDeconvolution.h:47
std::vector< double > mz_shifts_
m/z shifts between isotopic peaks (number of mz_shifts_ = peaks_per_peptide_ * number of mass_shifts_...
Definition: MultiplexPeakPattern.h:109
int peaks_per_peptide_
number of isotopic peaks in each peptide
Definition: MultiplexPeakPattern.h:119
int mass_shift_index_
index in mass shift list
Definition: MultiplexPeakPattern.h:130
data structure for pattern of isotopic peaks
Definition: MultiplexPeakPattern.h:54
int charge_
charge
Definition: MultiplexPeakPattern.h:114