OpenMS
2.5.0
Main Page
Related Pages
Modules
Namespaces
Namespace List
Namespace Members
All
_
a
b
c
d
e
f
g
h
i
j
k
l
m
n
o
p
q
r
s
t
u
v
w
x
Functions
_
a
c
d
e
f
g
h
i
l
m
n
o
p
q
r
s
t
u
v
w
x
Variables
a
b
c
d
e
f
g
h
i
j
k
l
m
n
o
p
r
s
t
v
w
x
Typedefs
a
b
c
d
e
f
i
m
o
p
q
r
s
t
u
x
Enumerations
Enumerator
a
c
i
m
n
o
p
r
s
Classes
Class List
Class Index
Class Hierarchy
Class Members
All
_
a
b
c
d
e
f
g
h
i
j
k
l
m
n
o
p
q
r
s
t
u
v
w
x
y
z
~
Functions
_
a
b
c
d
e
f
g
h
i
j
k
l
m
n
o
p
q
r
s
t
u
v
w
x
y
z
~
Variables
_
a
b
c
d
e
f
g
h
i
k
l
m
n
o
p
q
r
s
t
u
v
w
x
y
z
Typedefs
_
a
b
c
d
e
f
g
h
i
j
k
l
m
n
o
p
q
r
s
t
u
v
w
x
Enumerations
a
b
c
d
e
f
g
i
l
m
n
p
q
r
s
t
u
v
w
x
Enumerator
a
b
c
d
e
f
g
h
i
j
k
l
m
n
o
p
q
r
s
t
u
v
w
x
y
z
Properties
Related Functions
a
c
d
e
f
h
i
k
l
m
n
o
p
r
s
t
Files
File List
File Members
All
_
a
c
d
e
g
i
k
m
n
o
p
s
t
u
v
w
Functions
Variables
Typedefs
Macros
_
a
c
d
e
g
i
k
m
n
o
s
t
u
v
w
•
All
Classes
Namespaces
Files
Functions
Variables
Typedefs
Enumerations
Enumerator
Properties
Friends
Macros
Modules
Pages
OpenMS
TRANSFORMATIONS
FEATUREFINDER
MultiplexFilteredMSExperiment.h
Go to the documentation of this file.
1
// --------------------------------------------------------------------------
2
// OpenMS -- Open-Source Mass Spectrometry
3
// --------------------------------------------------------------------------
4
// Copyright The OpenMS Team -- Eberhard Karls University Tuebingen,
5
// ETH Zurich, and Freie Universitaet Berlin 2002-2020.
6
//
7
// This software is released under a three-clause BSD license:
8
// * Redistributions of source code must retain the above copyright
9
// notice, this list of conditions and the following disclaimer.
10
// * Redistributions in binary form must reproduce the above copyright
11
// notice, this list of conditions and the following disclaimer in the
12
// documentation and/or other materials provided with the distribution.
13
// * Neither the name of any author or any participating institution
14
// may be used to endorse or promote products derived from this software
15
// without specific prior written permission.
16
// For a full list of authors, refer to the file AUTHORS.
17
// --------------------------------------------------------------------------
18
// THIS SOFTWARE IS PROVIDED BY THE COPYRIGHT HOLDERS AND CONTRIBUTORS "AS IS"
19
// AND ANY EXPRESS OR IMPLIED WARRANTIES, INCLUDING, BUT NOT LIMITED TO, THE
20
// IMPLIED WARRANTIES OF MERCHANTABILITY AND FITNESS FOR A PARTICULAR PURPOSE
21
// ARE DISCLAIMED. IN NO EVENT SHALL ANY OF THE AUTHORS OR THE CONTRIBUTING
22
// INSTITUTIONS BE LIABLE FOR ANY DIRECT, INDIRECT, INCIDENTAL, SPECIAL,
23
// EXEMPLARY, OR CONSEQUENTIAL DAMAGES (INCLUDING, BUT NOT LIMITED TO,
24
// PROCUREMENT OF SUBSTITUTE GOODS OR SERVICES; LOSS OF USE, DATA, OR PROFITS;
25
// OR BUSINESS INTERRUPTION) HOWEVER CAUSED AND ON ANY THEORY OF LIABILITY,
26
// WHETHER IN CONTRACT, STRICT LIABILITY, OR TORT (INCLUDING NEGLIGENCE OR
27
// OTHERWISE) ARISING IN ANY WAY OUT OF THE USE OF THIS SOFTWARE, EVEN IF
28
// ADVISED OF THE POSSIBILITY OF SUCH DAMAGE.
29
//
30
// --------------------------------------------------------------------------
31
// $Maintainer: Lars Nilse $
32
// $Authors: Lars Nilse $
33
// --------------------------------------------------------------------------
34
35
#pragma once
36
37
#include <
OpenMS/KERNEL/StandardTypes.h
>
38
#include <
OpenMS/TRANSFORMATIONS/FEATUREFINDER/MultiplexFilteredPeak.h
>
39
40
#include <vector>
41
#include <algorithm>
42
#include <iostream>
43
44
namespace
OpenMS
45
{
52
class
OPENMS_DLLAPI
MultiplexFilteredMSExperiment
53
{
54
public
:
58
MultiplexFilteredMSExperiment
();
59
63
void
addPeak(
const
MultiplexFilteredPeak
& peak);
64
68
MultiplexFilteredPeak
getPeak(
size_t
i)
const
;
69
73
double
getMZ(
size_t
i)
const
;
74
78
std::vector<double> getMZ()
const
;
79
83
double
getRT(
size_t
i)
const
;
84
88
std::vector<double> getRT()
const
;
89
93
size_t
size()
const
;
94
101
void
writeDebugOutput(
const
MSExperiment
& exp_picked,
String
debug_out)
const
;
102
103
private
:
107
std::vector<MultiplexFilteredPeak>
result_
;
108
109
};
110
111
}
112
MultiplexFilteredPeak.h
OpenMS::MultiplexFilteredMSExperiment::result_
std::vector< MultiplexFilteredPeak > result_
peaks which passed the peak pattern filter
Definition:
MultiplexFilteredMSExperiment.h:107
OpenMS::MultiplexFilteredPeak
data structure storing a single peak that passed all filters
Definition:
MultiplexFilteredPeak.h:70
OpenMS::MSExperiment
In-Memory representation of a mass spectrometry experiment.
Definition:
MSExperiment.h:77
OpenMS::String
A more convenient string class.
Definition:
String.h:58
OpenMS::MultiplexFilteredMSExperiment
data structure storing all peaks (and optionally their raw data points) of an experiment correspondin...
Definition:
MultiplexFilteredMSExperiment.h:52
StandardTypes.h
OpenMS
Main OpenMS namespace.
Definition:
FeatureDeconvolution.h:46
Generated on Thu Feb 20 2020 21:03:07 for OpenMS by
1.8.16