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FeatureFinderAlgorithmPicked::IsotopePattern Struct Reference

#include <OpenMS/TRANSFORMATIONS/FEATUREFINDER/FeatureFinderAlgorithmPicked.h>

List of all members.


Detailed Description

template<class PeakType, class FeatureType>
struct OpenMS::FeatureFinderAlgorithmPicked< PeakType, FeatureType >::IsotopePattern

Helper structure for a found isotope pattern used in FeatureFinderAlgorithmPicked.

Public Member Functions

 IsotopePattern (UInt size)
 Constructor that resizes the internal vectors.

Public Attributes

std::vector< Intpeak
 Peak index (-1 if peak was not found, -2 if it was removed to improve the isotope fit).
std::vector< UIntspectrum
 Spectrum index (undefined if peak index is -1 or -2).
std::vector< DoubleRealintensity
 Peak intensity (0 if peak index is -1 or -2).
std::vector< DoubleRealmz_score
 m/z score of peak (0 if peak index is -1 or -2)
std::vector< DoubleRealtheoretical_mz
 Theoretical m/z value of the isotope peak.
TheoreticalIsotopePattern theoretical_ints
 Theoretical isotope pattern.

Constructor & Destructor Documentation

IsotopePattern ( UInt  size  )  [inline]

Constructor that resizes the internal vectors.


Member Data Documentation

std::vector<Int> peak

Peak index (-1 if peak was not found, -2 if it was removed to improve the isotope fit).

std::vector<UInt> spectrum

Spectrum index (undefined if peak index is -1 or -2).

std::vector<DoubleReal> intensity

Peak intensity (0 if peak index is -1 or -2).

std::vector<DoubleReal> mz_score

m/z score of peak (0 if peak index is -1 or -2)

std::vector<DoubleReal> theoretical_mz

Theoretical m/z value of the isotope peak.

TheoreticalIsotopePattern theoretical_ints

Theoretical isotope pattern.


The documentation for this struct was generated from the following file:
Generated Tue Apr 1 15:36:47 2008 -- using doxygen 1.5.4 OpenMS / TOPP 1.1