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MultiplexFilteringProfile.h
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31 // $Maintainer: Lars Nilse $
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34 
35 #ifndef OPENMS_TRANSFORMATIONS_FEATUREFINDER_MULTIPLEXFILTERINGPROFILE_H
36 #define OPENMS_TRANSFORMATIONS_FEATUREFINDER_MULTIPLEXFILTERINGPROFILE_H
37 
47 
48 #include <vector>
49 #include <algorithm>
50 #include <iostream>
51 
52 namespace OpenMS
53 {
67  class OPENMS_DLLAPI MultiplexFilteringProfile :
68  public MultiplexFiltering
69  {
70 public:
92  MultiplexFilteringProfile(const PeakMap& exp_profile, const PeakMap& exp_picked, const std::vector<std::vector<PeakPickerHiRes::PeakBoundary> >& boundaries, const std::vector<MultiplexIsotopicPeakPattern> patterns, int peaks_per_peptide_min, int peaks_per_peptide_max, bool missing_peaks, double intensity_cutoff, double mz_tolerance, bool mz_tolerance_unit, double peptide_similarity, double averagine_similarity, double averagine_similarity_scaling, String averagine_type="peptide");
93 
103  std::vector<MultiplexFilterResult> filter();
104 
105 private:
122  int nonLocalIntensityFilter_(const MultiplexIsotopicPeakPattern& pattern, const std::vector<double>& mz_shifts_actual, const std::vector<int>& mz_shifts_actual_indices, SplineSpectrum::Navigator nav, std::vector<double>& intensities_actual, int peaks_found_in_all_peptides, double mz) const;
123 
134  int findNearest_(int spectrum_index, double mz, double scaling) const;
135 
140  std::vector<std::vector<PeakPickerHiRes::PeakBoundary> > boundaries_;
141 
142  };
143 
144 }
145 
146 #endif /* MULTIPLEXFILTERINGPROFILE_H_ */
A more convenient string class.
Definition: String.h:57
std::vector< std::vector< PeakPickerHiRes::PeakBoundary > > boundaries_
Definition: MultiplexFilteringProfile.h:140
iterator class for access of spline packages
Definition: SplineSpectrum.h:102
Main OpenMS namespace.
Definition: FeatureDeconvolution.h:47
filters centroided and profile data for peak patterns
Definition: MultiplexFilteringProfile.h:67
data structure for pattern of isotopic peaks
Definition: MultiplexIsotopicPeakPattern.h:55
PeakMap exp_profile_
profile experimental data and peak boundaries
Definition: MultiplexFilteringProfile.h:139
In-Memory representation of a mass spectrometry experiment.
Definition: MSExperiment.h:82
base class for filtering centroided and profile data for peak patterns
Definition: MultiplexFiltering.h:72

OpenMS / TOPP release 2.3.0 Documentation generated on Tue Jan 9 2018 18:22:02 using doxygen 1.8.13