ProteoWizard
PrecursorRecalculatorDefault.hpp
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1 //
2 // $Id: PrecursorRecalculatorDefault.hpp 1191 2009-08-14 19:33:05Z chambm $
3 //
4 //
5 // Original author: Darren Kessner <darren@proteowizard.org>
6 //
7 // Copyright 2008 Spielberg Family Center for Applied Proteomics
8 // Cedars-Sinai Medical Center, Los Angeles, California 90048
9 //
10 // Licensed under the Apache License, Version 2.0 (the "License");
11 // you may not use this file except in compliance with the License.
12 // You may obtain a copy of the License at
13 //
14 // http://www.apache.org/licenses/LICENSE-2.0
15 //
16 // Unless required by applicable law or agreed to in writing, software
17 // distributed under the License is distributed on an "AS IS" BASIS,
18 // WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied.
19 // See the License for the specific language governing permissions and
20 // limitations under the License.
21 //
22 
23 
24 #ifndef _PRECURSORRECALCULATORDEFAULT_HPP_
25 #define _PRECURSORRECALCULATORDEFAULT_HPP_
26 
27 
30 
31 
32 namespace pwiz {
33 namespace analysis {
34 
35 
37 {
38  public:
39 
41  {
42  boost::shared_ptr<PeakFamilyDetector> peakFamilyDetector;
43  std::ostream* log;
44 
45  double mzLeftWidth;
46  double mzRightWidth;
47 
48  enum SortBy {SortBy_Proximity, SortBy_Score};
50 
51  Config() : log(0), mzLeftWidth(0), mzRightWidth(0), sortBy(SortBy_Proximity) {}
52  };
53 
54  PrecursorRecalculatorDefault(const Config&);
55 
56  virtual void recalculate(const MZIntensityPair* begin,
57  const MZIntensityPair* end,
58  const PrecursorInfo& initialEstimate,
59  std::vector<PrecursorInfo>& result) const;
60 
61  private:
62  class Impl;
63  boost::shared_ptr<Impl> impl_;
66 };
67 
68 
69 } // namespace analysis
70 } // namespace pwiz
71 
72 
73 #endif // _PRECURSORRECALCULATORDEFAULT_HPP_
74