OpenMS  2.5.0
Peak2D.h
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31 // $Maintainer: Timo Sachsenberg$
32 // $Authors: Marc Sturm $
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34 
35 #pragma once
36 
37 #include <OpenMS/CONCEPT/Types.h>
39 
40 #include <iosfwd>
41 #include <functional>
42 
43 namespace OpenMS
44 {
45 
54  class OPENMS_DLLAPI Peak2D
55  {
56 public:
57 
60 
62  typedef float IntensityType;
64  typedef double CoordinateType;
68 
71 
74  {
75  RT = 0,
76  MZ = 1,
77  DIMENSION = 2
78  };
79 
81  static char const * shortDimensionName(UInt const dim);
83  static char const * shortDimensionNameRT();
85  static char const * shortDimensionNameMZ();
86 
88  static char const * fullDimensionName(UInt const dim);
90  static char const * fullDimensionNameRT();
92  static char const * fullDimensionNameMZ();
93 
95  static char const * shortDimensionUnit(UInt const dim);
97  static char const * shortDimensionUnitRT();
99  static char const * shortDimensionUnitMZ();
100 
102  static char const * fullDimensionUnit(UInt const dim);
104  static char const * fullDimensionUnitRT();
106  static char const * fullDimensionUnitMZ();
107 
109 
110 protected:
111 
114 
116  static char const * const dimension_name_short_[DIMENSION];
117 
119  static char const * const dimension_name_full_[DIMENSION];
120 
122  static char const * const dimension_unit_short_[DIMENSION];
123 
125  static char const * const dimension_unit_full_[DIMENSION];
126 
128 
129 public:
130 
134  Peak2D() :
135  position_(),
136  intensity_(0)
137  {}
138 
140  explicit Peak2D(const PositionType& pos, const IntensityType in) :
141  position_(pos),
142  intensity_(in)
143  {}
144 
146  Peak2D(const Peak2D & p) = default;
147 
149  Peak2D(Peak2D&&) = default;
150 
160  {}
162 
167  {
168  return intensity_;
169  }
170 
172  void setIntensity(IntensityType intensity)
173  {
174  intensity_ = intensity;
175  }
176 
178  PositionType const & getPosition() const
179  {
180  return position_;
181  }
182 
185  {
186  return position_;
187  }
188 
191  {
192  position_ = position;
193  }
194 
197  {
198  return position_[MZ];
199  }
200 
202  void setMZ(CoordinateType coordinate)
203  {
204  position_[MZ] = coordinate;
205  }
206 
209  {
210  return position_[RT];
211  }
212 
214  void setRT(CoordinateType coordinate)
215  {
216  position_[RT] = coordinate;
217  }
218 
220 
222  Peak2D & operator=(const Peak2D & rhs) = default;
223 
225  Peak2D& operator=(Peak2D&&) & = default;
226 
228  bool operator==(const Peak2D & rhs) const
229  {
230 #pragma clang diagnostic push
231 #pragma clang diagnostic ignored "-Wfloat-equal"
232  return intensity_ == rhs.intensity_ && position_ == rhs.position_;
233 #pragma clang diagnostic pop
234  }
235 
237  bool operator!=(const Peak2D & rhs) const
238  {
239  return !(operator==(rhs));
240  }
241 
247  struct IntensityLess :
250  std::binary_function<Peak2D, Peak2D, bool>
251  {
252  bool operator()(const Peak2D & left, const Peak2D & right) const
253  {
254  return left.getIntensity() < right.getIntensity();
255  }
256 
257  bool operator()(const Peak2D & left, IntensityType right) const
258  {
259  return left.getIntensity() < right;
260  }
261 
262  bool operator()(IntensityType left, const Peak2D & right) const
263  {
264  return left < right.getIntensity();
265  }
266 
267  bool operator()(IntensityType left, IntensityType right) const
268  {
269  return left < right;
270  }
271 
272  };
273 
275  struct RTLess :
276  std::binary_function<Peak2D, Peak2D, bool>
277  {
278  bool operator()(const Peak2D & left, const Peak2D & right) const
279  {
280  return left.getRT() < right.getRT();
281  }
282 
283  bool operator()(const Peak2D & left, CoordinateType right) const
284  {
285  return left.getRT() < right;
286  }
287 
288  bool operator()(CoordinateType left, const Peak2D & right) const
289  {
290  return left < right.getRT();
291  }
292 
293  bool operator()(CoordinateType left, CoordinateType right) const
294  {
295  return left < right;
296  }
297 
298  };
299 
301  struct MZLess :
302  std::binary_function<Peak2D, Peak2D, bool>
303  {
304  bool operator()(const Peak2D & left, const Peak2D & right) const
305  {
306  return left.getMZ() < right.getMZ();
307  }
308 
309  bool operator()(const Peak2D & left, CoordinateType right) const
310  {
311  return left.getMZ() < right;
312  }
313 
314  bool operator()(CoordinateType left, const Peak2D & right) const
315  {
316  return left < right.getMZ();
317  }
318 
319  bool operator()(CoordinateType left, CoordinateType right) const
320  {
321  return left < right;
322  }
323 
324  };
325 
327  struct PositionLess :
328  public std::binary_function<Peak2D, Peak2D, bool>
329  {
330  bool operator()(const Peak2D & left, const Peak2D & right) const
331  {
332  return left.getPosition() < right.getPosition();
333  }
334 
335  bool operator()(const Peak2D & left, const PositionType & right) const
336  {
337  return left.getPosition() < right;
338  }
339 
340  bool operator()(const PositionType & left, const Peak2D & right) const
341  {
342  return left < right.getPosition();
343  }
344 
345  bool operator()(const PositionType & left, const PositionType & right) const
346  {
347  return left < right;
348  }
349 
350  };
352 
353  friend OPENMS_DLLAPI std::ostream & operator<<(std::ostream & os, const Peak2D & point);
354 
355 protected:
356 
361  };
362 
364  OPENMS_DLLAPI std::ostream & operator<<(std::ostream & os, const Peak2D & point);
365 
366 } // namespace OpenMS
367 
OpenMS::Peak2D::Peak2D
Peak2D(const PositionType &pos, const IntensityType in)
Member constructor.
Definition: Peak2D.h:140
OpenMS::Peak2D::getPosition
PositionType & getPosition()
Mutable access to the position.
Definition: Peak2D.h:184
OpenMS::Peak2D::intensity_
IntensityType intensity_
The data point intensity.
Definition: Peak2D.h:360
OpenMS::Peak2D::PositionLess::operator()
bool operator()(const Peak2D &left, const PositionType &right) const
Definition: Peak2D.h:335
double
DPosition.h
OpenMS::Peak2D::MZLess::operator()
bool operator()(CoordinateType left, CoordinateType right) const
Definition: Peak2D.h:319
Types.h
OpenMS::Peak2D::setPosition
void setPosition(const PositionType &position)
Mutable access to the position.
Definition: Peak2D.h:190
OpenMS::Peak2D
A 2-dimensional raw data point or peak.
Definition: Peak2D.h:54
OpenMS::Peak2D::PositionLess::operator()
bool operator()(const Peak2D &left, const Peak2D &right) const
Definition: Peak2D.h:330
OpenMS::Peak2D::MZLess::operator()
bool operator()(CoordinateType left, const Peak2D &right) const
Definition: Peak2D.h:314
OpenMS::Peak2D::IntensityLess::operator()
bool operator()(IntensityType left, IntensityType right) const
Definition: Peak2D.h:267
OpenMS::Peak2D::Peak2D
Peak2D()
Definition: Peak2D.h:134
OpenMS::Peak2D::getIntensity
IntensityType getIntensity() const
Definition: Peak2D.h:166
OpenMS::Peak2D::RTLess::operator()
bool operator()(const Peak2D &left, const Peak2D &right) const
Definition: Peak2D.h:278
OpenMS::Peak2D::RTLess::operator()
bool operator()(const Peak2D &left, CoordinateType right) const
Definition: Peak2D.h:283
OpenMS::Peak2D::setIntensity
void setIntensity(IntensityType intensity)
Non-mutable access to the data point intensity (height)
Definition: Peak2D.h:172
OpenMS::Peak2D::CoordinateType
double CoordinateType
Coordinate type (of the position)
Definition: Peak2D.h:64
OpenMS::Peak2D::PositionLess
Comparator by position. Lexicographical comparison (first RT then m/z) is done.
Definition: Peak2D.h:327
OpenMS::Peak2D::RTLess::operator()
bool operator()(CoordinateType left, CoordinateType right) const
Definition: Peak2D.h:293
OpenMS::Peak2D::setRT
void setRT(CoordinateType coordinate)
Mutable access to the RT coordinate (index 0)
Definition: Peak2D.h:214
OpenMS
Main OpenMS namespace.
Definition: FeatureDeconvolution.h:46
OpenMS::Peak2D::IntensityLess::operator()
bool operator()(IntensityType left, const Peak2D &right) const
Definition: Peak2D.h:262
OpenMS::Peak2D::IntensityLess::operator()
bool operator()(const Peak2D &left, IntensityType right) const
Definition: Peak2D.h:257
OpenMS::Peak2D::PositionLess::operator()
bool operator()(const PositionType &left, const PositionType &right) const
Definition: Peak2D.h:345
OpenMS::Peak2D::~Peak2D
~Peak2D()
Destructor.
Definition: Peak2D.h:159
OpenMS::Peak2D::IntensityType
float IntensityType
Intensity type.
Definition: Peak2D.h:62
OpenMS::Peak2D::operator!=
bool operator!=(const Peak2D &rhs) const
Equality operator.
Definition: Peak2D.h:237
OpenMS::Peak2D::DimensionDescription
DimensionDescription
This enum maps the symbolic names of the dimensions to numbers.
Definition: Peak2D.h:73
OpenMS::Peak2D::PositionType
DPosition< 2 > PositionType
Position type.
Definition: Peak2D.h:66
OpenMS::Peak2D::operator==
bool operator==(const Peak2D &rhs) const
Equality operator.
Definition: Peak2D.h:228
OpenMS::Peak2D::MZLess::operator()
bool operator()(const Peak2D &left, const Peak2D &right) const
Definition: Peak2D.h:304
OpenMS::Peak2D::setMZ
void setMZ(CoordinateType coordinate)
Mutable access to the m/z coordinate (index 1)
Definition: Peak2D.h:202
OpenMS::Peak2D::position_
PositionType position_
The data point position.
Definition: Peak2D.h:358
OpenMS::Peak2D::RTLess
Comparator by RT position.
Definition: Peak2D.h:275
OpenMS::operator<<
std::ostream & operator<<(std::ostream &os, const AccurateMassSearchResult &amsr)
OpenMS::Peak2D::getRT
CoordinateType getRT() const
Returns the RT coordinate (index 0)
Definition: Peak2D.h:208
OpenMS::DPosition< 2 >
OpenMS::UInt
unsigned int UInt
Unsigned integer type.
Definition: Types.h:94
KDTree::operator==
bool operator==(_Iterator< _Val, _Ref, _Ptr > const &, _Iterator< _Val, _Ref, _Ptr > const &)
Definition: KDTree.h:806
OpenMS::Peak2D::RTLess::operator()
bool operator()(CoordinateType left, const Peak2D &right) const
Definition: Peak2D.h:288
OpenMS::Peak2D::PositionLess::operator()
bool operator()(const PositionType &left, const Peak2D &right) const
Definition: Peak2D.h:340
float
OpenMS::Peak2D::getPosition
const PositionType & getPosition() const
Non-mutable access to the position.
Definition: Peak2D.h:178
OpenMS::Peak2D::MZLess::operator()
bool operator()(const Peak2D &left, CoordinateType right) const
Definition: Peak2D.h:309
OpenMS::Peak2D::IntensityLess::operator()
bool operator()(const Peak2D &left, const Peak2D &right) const
Definition: Peak2D.h:252
OpenMS::Peak2D::getMZ
CoordinateType getMZ() const
Returns the m/z coordinate (index 1)
Definition: Peak2D.h:196
OpenMS::Peak2D::MZLess
Comparator by m/z position.
Definition: Peak2D.h:301
seqan::position
Size< TNeedle >::Type position(const PatternAuxData< TNeedle > &dh)
Definition: AhoCorasickAmbiguous.h:561