52 SIZE_OF_ANNOTATIONSTATE
55 static const std::string NamesOfAnnotationState[SIZE_OF_ANNOTATIONSTATE];
72 quality_ = feature.quality_;
73 charge_ = feature.charge_;
74 width_ = feature.width_;
77 peptides_ = std::move(feature.peptides_);
78 primary_id_ = std::move(feature.primary_id_);
79 id_matches_ = std::move(feature.id_matches_);
190 const std::set<IdentificationData::ObservationMatchRef>&
getIDMatches()
const;
221 std::optional<IdentificationData::IdentifiedMolecule>
primary_id_;
A basic LC-MS feature.
Definition BaseFeature.h:34
const PeptideIdentificationList & getPeptideIdentifications() const
const ChargeType & getCharge() const
Non-mutable access to charge state.
std::optional< IdentificationData::IdentifiedMolecule > primary_id_
primary ID (peptide, RNA, compound) assigned to this feature
Definition BaseFeature.h:221
void setQuality(QualityType q)
Set the overall quality.
PeptideIdentificationList & getPeptideIdentifications()
returns a mutable reference to the PeptideIdentification vector
void setPeptideIdentifications(const PeptideIdentificationList &peptides)
sets the PeptideIdentification vector
const std::set< IdentificationData::ObservationMatchRef > & getIDMatches() const
immutable access to the set of matches (e.g. PSMs) with IDs for this feature
void sortPeptideIdentifications()
sorts PeptideIdentifications, assuming they have the same scoreType.
void clearPrimaryID()
clear any primary ID that was assigned
WidthType width_
Width (FWHM) for the feature. The default value is 0.0, a feature finding algorithm can compute this ...
Definition BaseFeature.h:215
bool operator==(const BaseFeature &rhs) const
Equality operator.
QualityType getQuality() const
BaseFeature & operator=(BaseFeature &&rhs) &=default
Move Assignment operator.
BaseFeature & operator=(const BaseFeature &rhs)=default
Assignment operator.
AnnotationState getAnnotationState() const
state of peptide identifications attached to this feature. If one ID has multiple hits,...
BaseFeature(const BaseFeature &rhs, UInt64 map_index)
Copy constructor with a new map_index.
ChargeType charge_
Charge of the peptide represented by this feature. The default value is 0, which represents an unknow...
Definition BaseFeature.h:212
const IdentificationData::IdentifiedMolecule & getPrimaryID() const
Return the primary ID (peptide, RNA, compound) assigned to this feature.
bool hasPrimaryID() const
float QualityType
Definition BaseFeature.h:39
float WidthType
Type of feature width/FWHM (RT)
Definition BaseFeature.h:43
BaseFeature(const BaseFeature &feature)=default
Copy constructor.
WidthType getWidth() const
Non-mutable access to the features width (full width at half max, FWHM)
Int ChargeType
Type of charge values.
Definition BaseFeature.h:41
void setWidth(WidthType fwhm)
Set the width of the feature (FWHM)
void addIDMatch(IdentificationData::ObservationMatchRef ref)
add an ID match (e.g. PSM) for this feature
bool operator!=(const BaseFeature &rhs) const
Inequality operator.
QualityType quality_
Overall quality measure of the feature.
Definition BaseFeature.h:209
BaseFeature(const RichPeak2D &point)
Constructor from raw data point with meta information.
void setCharge(const ChargeType &ch)
Set charge state.
std::set< IdentificationData::ObservationMatchRef > id_matches_
set of observation matches (e.g. PSMs) with IDs for this feature
Definition BaseFeature.h:224
BaseFeature(BaseFeature &&feature) noexcept
Definition BaseFeature.h:69
~BaseFeature() override
Destructor.
PeptideIdentificationList peptides_
PeptideIdentifications belonging to the feature.
Definition BaseFeature.h:218
std::set< IdentificationData::ObservationMatchRef > & getIDMatches()
mutable access to the set of matches (e.g. PSMs) with IDs for this feature
AnnotationState
state of identification, use getAnnotationState() to query it
Definition BaseFeature.h:47
@ FEATURE_ID_MULTIPLE_SAME
Definition BaseFeature.h:50
@ FEATURE_ID_SINGLE
Definition BaseFeature.h:49
@ FEATURE_ID_NONE
Definition BaseFeature.h:48
@ FEATURE_ID_MULTIPLE_DIVERGENT
Definition BaseFeature.h:51
void updateIDReferences(const IdentificationData::RefTranslator &trans)
Update ID references (primary ID, matches) for this feature.
BaseFeature(const Peak2D &point)
Constructor from raw data point.
BaseFeature(const FeatureHandle &fh)
Constructor from a featurehandle.
void setPrimaryID(const IdentificationData::IdentifiedMolecule &id)
set the primary ID (peptide, RNA, compound) for this feature
Representation of a Peak2D, RichPeak2D or Feature .
Definition FeatureHandle.h:36
A 2-dimensional raw data point or peak.
Definition Peak2D.h:30
Container for peptide identifications from multiple spectra.
Definition PeptideIdentificationList.h:66
A 2-dimensional raw data point or peak with meta information.
Definition RichPeak2D.h:30
int Int
Signed integer type.
Definition Types.h:72
uint64_t UInt64
Unsigned integer type (64bit)
Definition Types.h:47
Main OpenMS namespace.
Definition openswathalgo/include/OpenMS/OPENSWATHALGO/DATAACCESS/ISpectrumAccess.h:19
Compare by quality.
Definition BaseFeature.h:106
bool operator()(const BaseFeature &left, const BaseFeature &right) const
Definition BaseFeature.h:107
bool operator()(const QualityType &left, const QualityType &right) const
Definition BaseFeature.h:122
bool operator()(const BaseFeature &left, const QualityType &right) const
Definition BaseFeature.h:112
bool operator()(const QualityType &left, const BaseFeature &right) const
Definition BaseFeature.h:117
Variant type holding Peptide/Compound/Oligo references and convenience functions.
Definition IdentifiedMolecule.h:29
Wrapper that adds operator< to iterators, so they can be used as (part of) keys in maps/sets or multi...
Definition MetaData.h:20
structure that maps references of corresponding objects after copying
Definition IdentificationData.h:184