OpenMS  2.4.0
FeatureFinderAlgorithmMRM.h
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31 // $Maintainer: Timo Sachsenberg $
32 // $Authors: Andreas Bertsch $
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34 
35 #pragma once
36 
38 
39 namespace OpenMS
40 {
41  class InterpolationModel;
42 
59  class OPENMS_DLLAPI FeatureFinderAlgorithmMRM :
61  public FeatureFinderDefs
62  {
63 public:
65 
70 
76 
77 public:
78 
79  enum
80  {
81  RT = Peak2D::RT,
83  };
84 
87 
89  void run() override;
90 
91  static FeatureFinderAlgorithm* create();
92 
93  static const String getProductName();
94 
95 protected:
96 
97  double fitRT_(std::vector<Peak1D>& rt_input_data, InterpolationModel*& model) const;
98 
99  //Docu in base class
100  void updateMembers_() override;
101  };
102 
103 } // namespace OpenMS
104 
Param defaults_
Container for default parameters. This member should be filled in the constructor of derived classes!...
Definition: DefaultParamHandler.h:156
A more convenient string class.
Definition: String.h:57
FeatureFinder * ff_
Pointer to the calling FeatureFinder that is used to access the feature flags.
Definition: FeatureFinderAlgorithm.h:145
FeatureFinderAlgorithm for MRM experiments.
Definition: FeatureFinderAlgorithmMRM.h:59
FeatureMap * features_
Output data pointer.
Definition: FeatureFinderAlgorithm.h:142
Param param_
Container for current parameters.
Definition: DefaultParamHandler.h:149
const MapType * map_
Input data pointer.
Definition: FeatureFinderAlgorithm.h:139
Retention time dimension id (0 if used as a const int)
Definition: Peak2D.h:75
Abstract base class for FeatureFinder algorithms.
Definition: FeatureFinderAlgorithm.h:74
MapType::SpectrumType SpectrumType
Definition: FeatureFinderAlgorithmMRM.h:67
Mass-to-charge dimension id (1 if used as a const int)
Definition: Peak2D.h:76
FeatureFinderAlgorithm::MapType MapType
Definition: FeatureFinderAlgorithmMRM.h:66
Main OpenMS namespace.
Definition: FeatureDeconvolution.h:46
The purpose of this struct is to provide definitions of classes and typedefs which are used throughou...
Definition: FeatureFinderDefs.h:50
std::vector< FloatDataArray > FloatDataArrays
Definition: MSSpectrum.h:89
Abstract class for 1D-models that are approximated using linear interpolation.
Definition: InterpolationModel.h:54
The representation of a 1D spectrum.
Definition: MSSpectrum.h:66
SpectrumType::FloatDataArrays FloatDataArrays
Definition: FeatureFinderAlgorithmMRM.h:68
In-Memory representation of a mass spectrometry experiment.
Definition: MSExperiment.h:77