A structure representing a peak in a mass spectrum.
More...
#include <cPeak.h>
|
|
| cPeak () |
| | The constructor.
|
| |
| | cPeak (const cPeak &peak) |
| | The copy constructor. More...
|
| |
| cPeak & | operator= (const cPeak &peak) |
| | Overloaded operator=. More...
|
| |
|
void | clear () |
| | Clear the structure.
|
| |
| bool | empty () |
| | Test whether the structure is empty. More...
|
| |
| void | store (ofstream &os) |
| | Store the structure into an output stream. More...
|
| |
| void | load (ifstream &is) |
| | Load the structure from an input stream. More...
|
| |
| bool | equals (cPeak &secondpeak) |
| | Check if the object equals to another object. More...
|
| |
|
|
cSummaryFormula | formula |
| | Summary formlula.
|
| |
|
string | isotopeformula |
| | Isotope summary formula.
|
| |
|
int | isotopeformulaid |
| | Id of isotope summary formula.
|
| |
|
double | mzratio |
| | MZ ratio.
|
| |
|
double | relativeintensity |
| | Relative ntensity.
|
| |
|
double | absoluteintensity |
| | Absolute intensity.
|
| |
|
string | description |
| | Description of a peak.
|
| |
|
int | descriptionid |
| | Description id of a peak.
|
| |
|
double | matchedmz |
| | m/z ratio when the peak was matched with an experimental peak.
|
| |
|
double | matchedrelativeintensity |
| | Relative intensity when the peak was matched with an experimental peak.
|
| |
|
double | matchedabsoluteintensity |
| | Absolute intensity when the peak was matched with an experimental peak.
|
| |
|
double | matchedppm |
| | An error in ppm when the peak was matched with an experimental peak.
|
| |
|
eFragmentIonType | iontype |
| | Ion type corresponding to the peak.
|
| |
|
int | neutrallosstype |
| | Neutral loss type corresponding to the peak.
|
| |
|
int | matched |
| | Number of matches of an experimental peak (when the peak is compared to a theoretical spectrum).
|
| |
|
int | matchedid |
| | An order of an experimental peak which has been matched with a theoretical peak.
|
| |
|
int | charge |
| | A charge of the peak.
|
| |
|
int | rotationid |
| | Id of a rotation of a cyclic peptide or a permutation of a branched peptide which has been matched.
|
| |
|
int | seriesid |
| | An order of a peak in a series (e.g., B_5 in a B series).
|
| |
|
int | groupid |
| | Identifier of a group of peaks.
|
| |
|
int | compoundid |
| | Identifier of a compound.
|
| |
|
bool | isotope |
| | True if the peak is an isotope peak.
|
| |
|
bool | removeme |
| | True if the peak should be removed.
|
| |
|
bool | scrambled |
| | True if the peak corresponds to a scrambled fragment ion.
|
| |
|
bool | decoy |
| | True if the peak corresponds to a decoy compound.
|
| |
|
int | orderid |
| | An order id of a peak in a peaklist.
|
| |
A structure representing a peak in a mass spectrum.
◆ cPeak()
| cPeak::cPeak |
( |
const cPeak & |
peak | ) |
|
The copy constructor.
- Parameters
-
◆ empty()
Test whether the structure is empty.
- Return values
-
| bool | true when the structure is empty |
◆ equals()
| bool cPeak::equals |
( |
cPeak & |
secondpeak | ) |
|
Check if the object equals to another object.
- Parameters
-
| secondpeak | object for comparison |
- Return values
-
| bool | true if the objects are equals |
◆ load()
| void cPeak::load |
( |
ifstream & |
is | ) |
|
Load the structure from an input stream.
- Parameters
-
◆ operator=()
Overloaded operator=.
- Parameters
-
◆ store()
| void cPeak::store |
( |
ofstream & |
os | ) |
|
Store the structure into an output stream.
- Parameters
-
The documentation for this struct was generated from the following files: