libpappsomspp
Library for mass spectrometry
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psmfeatures.h
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1/**
2 * \file pappsomspp/processing/cbor/psm/evalscan/psmfeatures.h
3 * \date 15/07/2025
4 * \author Olivier Langella
5 * \brief compute features on scan's PSM
6 */
7
8/*******************************************************************************
9 * Copyright (c) 2025 Olivier Langella <Olivier.Langella@universite-paris-saclay.fr>.
10 *
11 * This file is part of PAPPSOms-tools.
12 *
13 * PAPPSOms-tools is free software: you can redistribute it and/or modify
14 * it under the terms of the GNU General Public License as published by
15 * the Free Software Foundation, either version 3 of the License, or
16 * (at your option) any later version.
17 *
18 * PAPPSOms-tools is distributed in the hope that it will be useful,
19 * but WITHOUT ANY WARRANTY; without even the implied warranty of
20 * MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
21 * GNU General Public License for more details.
22 *
23 * You should have received a copy of the GNU General Public License
24 * along with PAPPSOms-tools. If not, see <http://www.gnu.org/licenses/>.
25 *
26 ******************************************************************************/
27#pragma once
28
32#include <QJsonObject>
33
34namespace pappso
35{
36namespace cbor
37{
38namespace psm
39{
40
41/**
42 * @todo write docs
43 */
45{
46 public:
47 /**
48 * Default constructor
49 */
50 PsmFeatures(std::size_t buffer_scan_size, CborStreamWriter *cbor_output_p);
51 PsmFeatures(std::size_t buffer_scan_size,
52 CborStreamWriter *cbor_output_p,
53 const QJsonObject &parameters);
54
55
56 /**
57 * Destructor
58 */
59 virtual ~PsmFeatures();
60
61
62 protected:
64
65 void parameterMapReady(pappso::UiMonitorInterface &monitor) override;
66
67 private:
69 double m_minimumMz = 150;
70 std::list<pappso::Enums::PeptideIon> m_ionList;
73};
74} // namespace psm
75} // namespace cbor
76} // namespace pappso
CborScanMapBase * newCborScanMap() override
pappso::XtandemSpectrumProcess m_tandemSpectrumProcess
Definition psmfeatures.h:68
void parameterMapReady(pappso::UiMonitorInterface &monitor) override
pappso::PsmFeatures * mpa_psmFeatures
Definition psmfeatures.h:72
pappso::PrecisionPtr m_fragmentTolerance
Definition psmfeatures.h:71
PsmFeatures(std::size_t buffer_scan_size, CborStreamWriter *cbor_output_p)
std::list< pappso::Enums::PeptideIon > m_ionList
Definition psmfeatures.h:70
PsmFileScanProcessAndCopy(std::size_t buffer_scan_size, CborStreamWriter *cbor_output_p, const QString &operation)
tries to keep as much as possible monoisotopes, removing any possible C13 peaks and changes multichar...
Definition aa.cpp:39
const PrecisionBase * PrecisionPtr
Definition precision.h:122