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: Andreas Bertsch $ 00032 // $Authors: Andreas Bertsch $ 00033 // -------------------------------------------------------------------------- 00034 00035 00036 #ifndef OPENMS_ANALYSIS_ID_PILISIDENTIFICATION_H 00037 #define OPENMS_ANALYSIS_ID_PILISIDENTIFICATION_H 00038 00039 #include <OpenMS/ANALYSIS/ID/PILISModel.h> 00040 #include <OpenMS/METADATA/PeptideIdentification.h> 00041 #include <OpenMS/KERNEL/StandardTypes.h> 00042 00043 #include <vector> 00044 #include <map> 00045 00046 namespace OpenMS 00047 { 00048 // forward declarations 00049 class PeakSpectrumCompareFunctor; 00050 00061 class OPENMS_DLLAPI PILISIdentification : 00062 public DefaultParamHandler 00063 { 00064 00065 public: 00066 00070 00071 PILISIdentification(); 00072 00074 PILISIdentification(const PILISIdentification & source); 00075 00077 virtual ~PILISIdentification(); 00079 00081 PILISIdentification & operator=(const PILISIdentification & source); 00082 00086 00087 //void setSequenceDB(const SuffixArrayPeptideFinder& sapf); 00088 00090 void setModel(PILISModel * hmm_model); 00091 00093 void getIdentifications(const std::vector<std::map<String, UInt> > & candidates, std::vector<PeptideIdentification> & ids, const RichPeakMap & exp); 00094 00096 void getIdentification(const std::map<String, UInt> & candidates, PeptideIdentification & id, const RichPeakSpectrum & spectrum); 00098 00099 protected: 00100 00102 void getSpectrum_(RichPeakSpectrum & spec, const String & sequence, int charge); 00103 00105 void getPreIdentification_(PeptideIdentification & id, const RichPeakSpectrum & spec, const std::map<String, UInt> & cand_peptides); 00106 00108 void getFinalIdentification_(PeptideIdentification & id, const RichPeakSpectrum & spec, const PeptideIdentification & pre_id); 00109 00111 PILISModel * getPILISModel_(); 00112 00114 //PILISSequenceDB* getSequenceDB_(); 00115 //SuffixArrayPeptideFinder* getSequenceDB_(); 00116 00118 //PILISSequenceDB* sequence_db_; 00119 //SuffixArrayPeptideFinder sapf_; 00120 00122 PILISModel * hmm_model_; 00123 00125 Map<char, double> aa_weight_; 00126 00128 PeakSpectrumCompareFunctor * pre_scorer_; 00129 00131 PeakSpectrumCompareFunctor * scorer_; 00132 00134 RichPeak1D p_; 00135 00137 std::vector<RichPeakSpectrum> sim_specs_; 00138 00140 bool own_sequence_db_; 00141 00143 bool own_model_; 00144 00146 void updateMembers_(); 00147 }; 00148 } 00149 00150 #endif
| OpenMS / TOPP release 1.10.0 | Documentation generated on Thu Mar 7 2013 09:42:43 using doxygen 1.7.1 |