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Library for mass spectrometry
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timsmsrunreader.h
Go to the documentation of this file.
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/**
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* \file pappsomspp/msrun/private/timsmsrunreader.h
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* \date 05/09/2019
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* \author Olivier Langella
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* \brief MSrun file reader for native Bruker TimsTOF raw data
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*/
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/*******************************************************************************
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* Copyright (c) 2019 Olivier Langella <Olivier.Langella@u-psud.fr>.
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*
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* This file is part of the PAPPSOms++ library.
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*
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* PAPPSOms++ is free software: you can redistribute it and/or modify
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* it under the terms of the GNU General Public License as published by
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* the Free Software Foundation, either version 3 of the License, or
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* (at your option) any later version.
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*
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* PAPPSOms++ is distributed in the hope that it will be useful,
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* but WITHOUT ANY WARRANTY; without even the implied warranty of
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* MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
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* GNU General Public License for more details.
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*
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* You should have received a copy of the GNU General Public License
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* along with PAPPSOms++. If not, see <http://www.gnu.org/licenses/>.
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*
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******************************************************************************/
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#pragma once
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#include "
pappsomspp/core/msrun/private/timsmsrunreaderbase.h
"
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namespace
pappso
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{
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class
PMSPP_LIB_DECL
TimsMsRunReader
:
public
TimsMsRunReaderBase
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{
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friend
class
MsFileAccessor
;
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/**
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* @todo write docs
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*/
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public
:
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TimsMsRunReader
(
MsRunIdCstSPtr
&msrun_id_csp);
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TimsMsRunReader
(
const
TimsMsRunReaderBase
&msrun_reader_base);
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virtual
~TimsMsRunReader
();
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virtual
MassSpectrumSPtr
massSpectrumSPtr
(std::size_t spectrum_index)
override
;
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virtual
MassSpectrumCstSPtr
massSpectrumCstSPtr
(std::size_t spectrum_index)
override
;
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virtual
QualifiedMassSpectrum
qualifiedMassSpectrum
(std::size_t spectrum_index,
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bool
want_binary_data =
true
)
const override
;
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virtual
void
readSpectrumCollection
(
SpectrumCollectionHandlerInterface
&handler)
override
;
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virtual
void
readSpectrumCollection2
(
const
MsRunReadConfig
&config,
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SpectrumCollectionHandlerInterface
&handler)
override
;
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virtual
void
readSpectrumCollectionByMsLevel
(
SpectrumCollectionHandlerInterface
&handler,
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unsigned
int
ms_level)
override
;
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virtual
std::size_t
spectrumListSize
()
const override
;
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virtual
std::size_t
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spectrumStringIdentifier2SpectrumIndex
(
const
QString &spectrum_identifier)
override
;
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};
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}
// namespace pappso
pappso::MsRunReadConfig
Definition
msrunreadconfig.h:62
pappso::QualifiedMassSpectrum
Class representing a fully specified mass spectrum.
Definition
qualifiedmassspectrum.h:98
pappso::SpectrumCollectionHandlerInterface
interface to collect spectrums from the MsRunReader class
Definition
spectrumcollectionhandlerinterface.h:52
pappso::TimsMsRunReaderBase::TimsMsRunReaderBase
TimsMsRunReaderBase(MsRunIdCstSPtr &msrun_id_csp)
Definition
timsmsrunreaderbase.cpp:38
pappso::TimsMsRunReader::TimsMsRunReader
TimsMsRunReader(MsRunIdCstSPtr &msrun_id_csp)
Definition
timsmsrunreader.cpp:37
pappso::TimsMsRunReader::spectrumStringIdentifier2SpectrumIndex
virtual std::size_t spectrumStringIdentifier2SpectrumIndex(const QString &spectrum_identifier) override
if possible, get the spectrum index given a string identifier throw a not found exception if spectrum...
Definition
timsmsrunreader.cpp:646
pappso::TimsMsRunReader::readSpectrumCollection2
virtual void readSpectrumCollection2(const MsRunReadConfig &config, SpectrumCollectionHandlerInterface &handler) override
function to visit an MsRunReader and get each Spectrum in a spectrum collection handler
Definition
timsmsrunreader.cpp:88
pappso::TimsMsRunReader::MsFileAccessor
friend class MsFileAccessor
Definition
timsmsrunreader.h:38
pappso::TimsMsRunReader::readSpectrumCollection
virtual void readSpectrumCollection(SpectrumCollectionHandlerInterface &handler) override
function to visit an MsRunReader and get each Spectrum in a spectrum collection handler
Definition
timsmsrunreader.cpp:82
pappso::TimsMsRunReader::readSpectrumCollectionByMsLevel
virtual void readSpectrumCollectionByMsLevel(SpectrumCollectionHandlerInterface &handler, unsigned int ms_level) override
function to visit an MsRunReader and get each Spectrum in a spectrum collection handler by Ms Levels
Definition
timsmsrunreader.cpp:609
pappso::TimsMsRunReader::massSpectrumCstSPtr
virtual MassSpectrumCstSPtr massSpectrumCstSPtr(std::size_t spectrum_index) override
Definition
timsmsrunreader.cpp:63
pappso::TimsMsRunReader::massSpectrumSPtr
virtual MassSpectrumSPtr massSpectrumSPtr(std::size_t spectrum_index) override
get a MassSpectrumSPtr class given its spectrum index
Definition
timsmsrunreader.cpp:54
pappso::TimsMsRunReader::qualifiedMassSpectrum
virtual QualifiedMassSpectrum qualifiedMassSpectrum(std::size_t spectrum_index, bool want_binary_data=true) const override
get a QualifiedMassSpectrum class given its scan number
Definition
timsmsrunreader.cpp:70
pappso::TimsMsRunReader::spectrumListSize
virtual std::size_t spectrumListSize() const override
get the totat number of spectrum conained in the MSrun data file
Definition
timsmsrunreader.cpp:640
PMSPP_LIB_DECL
#define PMSPP_LIB_DECL
Definition
export-import-config.h:14
pappso
tries to keep as much as possible monoisotopes, removing any possible C13 peaks and changes multichar...
Definition
aa.cpp:39
pappso::MsRunIdCstSPtr
std::shared_ptr< const MsRunId > MsRunIdCstSPtr
Definition
msrunid.h:46
pappso::MassSpectrumCstSPtr
std::shared_ptr< const MassSpectrum > MassSpectrumCstSPtr
Definition
massspectrum.h:54
pappso::MassSpectrumSPtr
std::shared_ptr< MassSpectrum > MassSpectrumSPtr
Definition
massspectrum.h:53
timsmsrunreaderbase.h
pappsomspp
core
msrun
private
timsmsrunreader.h
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