00001 // -------------------------------------------------------------------------- 00002 // OpenMS -- Open-Source Mass Spectrometry 00003 // -------------------------------------------------------------------------- 00004 // Copyright The OpenMS Team -- Eberhard Karls University Tuebingen, 00005 // ETH Zurich, and Freie Universitaet Berlin 2002-2012. 00006 // 00007 // This software is released under a three-clause BSD license: 00008 // * Redistributions of source code must retain the above copyright 00009 // notice, this list of conditions and the following disclaimer. 00010 // * Redistributions in binary form must reproduce the above copyright 00011 // notice, this list of conditions and the following disclaimer in the 00012 // documentation and/or other materials provided with the distribution. 00013 // * Neither the name of any author or any participating institution 00014 // may be used to endorse or promote products derived from this software 00015 // without specific prior written permission. 00016 // For a full list of authors, refer to the file AUTHORS. 00017 // -------------------------------------------------------------------------- 00018 // THIS SOFTWARE IS PROVIDED BY THE COPYRIGHT HOLDERS AND CONTRIBUTORS "AS IS" 00019 // AND ANY EXPRESS OR IMPLIED WARRANTIES, INCLUDING, BUT NOT LIMITED TO, THE 00020 // IMPLIED WARRANTIES OF MERCHANTABILITY AND FITNESS FOR A PARTICULAR PURPOSE 00021 // ARE DISCLAIMED. IN NO EVENT SHALL ANY OF THE AUTHORS OR THE CONTRIBUTING 00022 // INSTITUTIONS BE LIABLE FOR ANY DIRECT, INDIRECT, INCIDENTAL, SPECIAL, 00023 // EXEMPLARY, OR CONSEQUENTIAL DAMAGES (INCLUDING, BUT NOT LIMITED TO, 00024 // PROCUREMENT OF SUBSTITUTE GOODS OR SERVICES; LOSS OF USE, DATA, OR PROFITS; 00025 // OR BUSINESS INTERRUPTION) HOWEVER CAUSED AND ON ANY THEORY OF LIABILITY, 00026 // WHETHER IN CONTRACT, STRICT LIABILITY, OR TORT (INCLUDING NEGLIGENCE OR 00027 // OTHERWISE) ARISING IN ANY WAY OUT OF THE USE OF THIS SOFTWARE, EVEN IF 00028 // ADVISED OF THE POSSIBILITY OF SUCH DAMAGE. 00029 // 00030 // -------------------------------------------------------------------------- 00031 // $Maintainer: Clemens Groepl $ 00032 // $Authors: $ 00033 // -------------------------------------------------------------------------- 00034 00035 #ifndef OPENMS_TRANSFORMATIONS_FEATUREFINDER_FITTER1D_H 00036 #define OPENMS_TRANSFORMATIONS_FEATUREFINDER_FITTER1D_H 00037 00038 #include <OpenMS/DATASTRUCTURES/IsotopeCluster.h> 00039 #include <OpenMS/DATASTRUCTURES/DefaultParamHandler.h> 00040 #include <OpenMS/CONCEPT/Exception.h> 00041 #include <OpenMS/KERNEL/Feature.h> 00042 #include <OpenMS/MATH/STATISTICS/BasicStatistics.h> 00043 #include <OpenMS/TRANSFORMATIONS/FEATUREFINDER/FeatureFinderDefs.h> 00044 00045 namespace OpenMS 00046 { 00047 class InterpolationModel; 00048 00059 class OPENMS_DLLAPI Fitter1D : 00060 public DefaultParamHandler, 00061 public FeatureFinderDefs 00062 { 00063 public: 00064 00066 typedef IsotopeCluster::IndexSet IndexSet; 00068 typedef IsotopeCluster::ChargedIndexSet ChargedIndexSet; 00070 typedef Feature::CoordinateType CoordinateType; 00072 typedef Feature::QualityType QualityType; 00074 typedef Peak1D PeakType; 00076 typedef std::vector<PeakType> RawDataArrayType; 00078 typedef RawDataArrayType::iterator PeakIterator; 00079 00081 Fitter1D(); 00082 00084 Fitter1D(const Fitter1D & source); 00085 00087 virtual ~Fitter1D() 00088 { 00089 } 00090 00092 virtual Fitter1D & operator=(const Fitter1D & source); 00093 00095 virtual QualityType fit1d(const RawDataArrayType & /* range */, InterpolationModel * & /* model */) 00096 { 00097 throw Exception::NotImplemented(__FILE__, __LINE__, __PRETTY_FUNCTION__); 00098 } 00099 00101 static void registerChildren(); 00102 00103 protected: 00104 00106 CoordinateType tolerance_stdev_box_; 00108 CoordinateType min_; 00110 CoordinateType max_; 00112 CoordinateType stdev1_; 00114 CoordinateType stdev2_; 00116 Math::BasicStatistics<> statistics_; 00118 CoordinateType interpolation_step_; 00119 00120 virtual void updateMembers_(); 00121 00122 }; 00123 00124 } 00125 00126 #endif // OPENMS_TRANSFORMATIONS_FEATUREFINDER_FITTER1D_H
| OpenMS / TOPP release 1.10.0 | Documentation generated on Thu Mar 7 2013 09:42:39 using doxygen 1.7.1 |