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SpectrumAccessOpenMSInMemory.h
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1// Copyright (c) 2002-present, OpenMS Inc. -- EKU Tuebingen, ETH Zurich, and FU Berlin
2// SPDX-License-Identifier: BSD-3-Clause
3//
4// --------------------------------------------------------------------------
5// $Maintainer: Hannes Roest $
6// $Authors: Hannes Roest $
7// --------------------------------------------------------------------------
8
9#pragma once
10
15
17
18#include <memory>
19
20namespace OpenMS
21{
47 class OPENMS_DLLAPI SpectrumAccessOpenMSInMemory :
49 {
50public:
54
57
60
63
65 std::shared_ptr<OpenSwath::ISpectrumAccess> lightClone() const override;
66
68
70
71 std::vector<std::size_t> getSpectraByRT(double RT, double deltaRT) const override;
72
73 size_t getNrSpectra() const override;
74
76
77 size_t getNrChromatograms() const override;
78
79 std::string getChromatogramNativeID(int id) const override;
80
81private:
82
83 std::vector< OpenSwath::SpectrumPtr > spectra_;
84 std::vector< OpenSwath::SpectrumMeta > spectra_meta_;
85
86 std::vector< OpenSwath::ChromatogramPtr > chromatograms_;
87 std::vector< std::string > chromatogram_ids_;
88
89 };
90
91} //end namespace OpenMS
92
The representation of a chromatogram.
Definition MSChromatogram.h:30
In-Memory representation of a mass spectrometry run.
Definition MSExperiment.h:49
The representation of a 1D spectrum.
Definition MSSpectrum.h:44
An implementation of the OpenSWATH Spectrum Access interface completely in memory.
Definition SpectrumAccessOpenMSInMemory.h:49
std::shared_ptr< OpenSwath::ISpectrumAccess > lightClone() const override
Light clone operator (actual data will not get copied)
OpenMS::PeakMap MSExperimentType
Definition SpectrumAccessOpenMSInMemory.h:51
size_t getNrSpectra() const override
Returns the number of spectra available.
~SpectrumAccessOpenMSInMemory() override
Destructor.
OpenMS::MSSpectrum MSSpectrumType
Definition SpectrumAccessOpenMSInMemory.h:52
SpectrumAccessOpenMSInMemory(const SpectrumAccessOpenMSInMemory &rhs)
Copy constructor.
size_t getNrChromatograms() const override
Returns the number of chromatograms available.
OpenMS::MSChromatogram MSChromatogramType
Definition SpectrumAccessOpenMSInMemory.h:53
std::vector< OpenSwath::ChromatogramPtr > chromatograms_
Definition SpectrumAccessOpenMSInMemory.h:86
OpenSwath::ChromatogramPtr getChromatogramById(int id) override
Return a pointer to a chromatogram at the given id.
std::vector< std::string > chromatogram_ids_
Definition SpectrumAccessOpenMSInMemory.h:87
std::vector< OpenSwath::SpectrumPtr > spectra_
Definition SpectrumAccessOpenMSInMemory.h:83
OpenSwath::SpectrumPtr getSpectrumById(int id) override
Return a pointer to a spectrum at the given id.
std::vector< OpenSwath::SpectrumMeta > spectra_meta_
Definition SpectrumAccessOpenMSInMemory.h:84
std::string getChromatogramNativeID(int id) const override
Returns the native id of the chromatogram at the given id.
std::vector< std::size_t > getSpectraByRT(double RT, double deltaRT) const override
Return a vector of ids of spectra that are within RT +/- deltaRT.
SpectrumAccessOpenMSInMemory(OpenSwath::ISpectrumAccess &origin)
Constructor.
OpenSwath::SpectrumMeta getSpectrumMetaById(int id) const override
Returns the meta information for a spectrum.
The interface of a mass spectrometry experiment.
Definition openswathalgo/include/OpenMS/OPENSWATHALGO/DATAACCESS/ISpectrumAccess.h:30
Main OpenMS namespace.
Definition openswathalgo/include/OpenMS/OPENSWATHALGO/DATAACCESS/ISpectrumAccess.h:19
std::shared_ptr< Chromatogram > ChromatogramPtr
Definition openswathalgo/include/OpenMS/OPENSWATHALGO/DATAACCESS/DataStructures.h:153
std::shared_ptr< Spectrum > SpectrumPtr
Definition openswathalgo/include/OpenMS/OPENSWATHALGO/DATAACCESS/DataStructures.h:290
Identifying information for a spectrum.
Definition openswathalgo/include/OpenMS/OPENSWATHALGO/DATAACCESS/DataStructures.h:157