OpenMS
PeptideMass.h
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1 // Copyright (c) 2002-2023, The OpenMS Team -- EKU Tuebingen, ETH Zurich, and FU Berlin
2 // SPDX-License-Identifier: BSD-3-Clause
3 //
4 // --------------------------------------------------------------------------
5 // $Maintainer: Chris Bielow $
6 // $Authors: Chris Bielow $
7 // --------------------------------------------------------------------------
8 
9 #pragma once
10 
11 #include <OpenMS/QC/QCBase.h>
12 
13 namespace OpenMS
14 {
15  class FeatureMap;
16 
23  class OPENMS_DLLAPI PeptideMass : public QCBase
24  {
25  public:
27  PeptideMass() = default;
28 
30  virtual ~PeptideMass() = default;
31 
37  void compute(FeatureMap& features);
38 
39 
40  const String& getName() const override;
41 
42  Status requirements() const override;
43  };
44 
45 } // namespace OpenMS
OpenMS::FeatureMap
A container for features.
Definition: FeatureMap.h:80
OpenMS::FlagSet
Stores and handles combinations of enum values, e.g. a set of flags as bits flipped in an UInt64.
Definition: FlagSet.h:28
OpenMS::PeptideMass
QC metric calculating theoretical mass of a peptide sequence.
Definition: PeptideMass.h:24
OpenMS::PeptideMass::getName
const String & getName() const override
Returns the name of the metric.
OpenMS::PeptideMass::compute
void compute(FeatureMap &features)
Sets the 'mass' metavalue to all PeptideHits by computing the theoretical mass.
OpenMS::PeptideMass::requirements
Status requirements() const override
Returns the input data requirements of the compute(...) function.
OpenMS::PeptideMass::PeptideMass
PeptideMass()=default
Constructor.
OpenMS::PeptideMass::~PeptideMass
virtual ~PeptideMass()=default
Destructor.
OpenMS::QCBase
This class serves as an abstract base class for all QC classes.
Definition: QCBase.h:29
OpenMS::String
A more convenient string class.
Definition: String.h:34
OpenMS
Main OpenMS namespace.
Definition: FeatureDeconvolution.h:22