MetaboTargetedAssay.h File Reference

#include <OpenMS/KERNEL/StandardTypes.h>
#include <map>
#include <OpenMS/ANALYSIS/MRM/ReactionMonitoringTransition.h>
#include <OpenMS/ANALYSIS/TARGETED/TargetedExperiment.h>
#include <OpenMS/ANALYSIS/ID/SiriusMSConverter.h>
#include <OpenMS/FORMAT/DATAACCESS/SiriusFragmentAnnotation.h>
#include <OpenMS/CONCEPT/Exception.h>

Go to the source code of this file.

Classes
class	MetaboTargetedAssay
	This class provides methods for the extraction of targeted assays for metabolomics. More...
class	MetaboTargetedAssay::CompoundTargetDecoyPair
	CompoundTargetDecoyPair stores a pair of CompoundInfo and MSSpectrum (target, decoy) More...
class	MetaboTargetedAssay::CompoundSpectrumPair
	CompoundTargetDecoyPair stores a pair of CompoundInfo and MSSpectrum. More...
struct	MetaboTargetedAssay::TargetDecoyGroup
	TargetDecoyGroup stores the mz, rt and file number in correspondence to the index of a MetaboTargetedAssay vector. More...

Namespaces
	OpenMS
	Main OpenMS namespace.

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Class Documentation

OpenMS::MetaboTargetedAssay::TargetDecoyGroup

struct OpenMS::MetaboTargetedAssay::TargetDecoyGroup

TargetDecoyGroup stores the mz, rt and file number in correspondence to the index of a MetaboTargetedAssay vector.

Class Members
int	decoy_file_number
int	decoy_index
double	decoy_mz
double	decoy_rt
int	target_file_number
int	target_index
double	target_mz
double	target_rt