49 #ifndef OPENMS_TRANSFORMATIONS_FEATUREFINDER_SUPERHIRN_MSPEAK_H
50 #define OPENMS_TRANSFORMATIONS_FEATUREFINDER_SUPERHIRN_MSPEAK_H
99 MSPeak(
int,
double,
float);
101 MSPeak(
int,
double,
float,
unsigned int,
unsigned int,
float, std::vector<CentroidPeak>);
117 void activateAsPrecursorPeak(
int);
121 bool checkIsotopeBelongingAndAdjustMass(
double,
double);
135 return ISOPEAKS.begin();
140 return ISOPEAKS.end();
145 extraMSPeakInfo = in;
150 return extraMSPeakInfo;
178 return precursorMass;
238 return SignalToNoise;
250 #endif // OPENMS_TRANSFORMATIONS_FEATUREFINDER_SUPERHIRN_MSPEAK_H
std::vector< CentroidPeak > & get_isotopic_peaks()
Definition: MSPeak.h:128
int get_scan_number()
Definition: MSPeak.h:206
double precursorMZ
Definition: MSPeak.h:70
double MZ
Definition: MSPeak.h:71
int SCAN
Definition: MSPeak.h:73
void setExtraPeakInfo(std::string in)
Definition: MSPeak.h:143
void setPrecursorCHRG(int in)
Definition: MSPeak.h:165
int childScan
Definition: MSPeak.h:83
void set_Chrg(int z)
Definition: MSPeak.h:186
void setPrecursorMZ(double in)
Definition: MSPeak.h:154
double get_MZ()
Definition: MSPeak.h:201
double SignalToNoise
Definition: MSPeak.h:85
float get_score()
Definition: MSPeak.h:231
int getPrecursorCHRG()
Definition: MSPeak.h:170
float INTENSITY
Definition: MSPeak.h:72
int get_Scan()
Definition: MSPeak.h:191
int get_Chrg()
Definition: MSPeak.h:181
void set_retention_time(double IN)
Definition: MSPeak.h:211
double get_retention_time()
Definition: MSPeak.h:216
float SCORE
Definition: MSPeak.h:77
std::vector< CentroidPeak >::iterator get_isotopic_peaks_start()
Definition: MSPeak.h:133
std::vector< CentroidPeak >::iterator get_isotopic_peaks_end()
Definition: MSPeak.h:138
unsigned int get_charge_state()
Definition: MSPeak.h:221
double getSignalToNoise()
Definition: MSPeak.h:236
std::string getExtraPeakInfo()
Definition: MSPeak.h:148
unsigned int NRISOTOPES
Definition: MSPeak.h:76
void setSignalToNoise(double in)
Definition: MSPeak.h:241
bool precursorMass
Definition: MSPeak.h:82
unsigned int CHRG
Definition: MSPeak.h:75
double getPrecursorMZ()
Definition: MSPeak.h:159
std::string extraMSPeakInfo
Definition: MSPeak.h:79
float get_intensity()
Definition: MSPeak.h:196
unsigned int get_nr_isotopes()
Definition: MSPeak.h:226
std::vector< CentroidPeak > ISOPEAKS
Definition: MSPeak.h:86
bool getPrecursorActivation()
Definition: MSPeak.h:176
double TR
Definition: MSPeak.h:74