libpappsomspp
Library for mass spectrometry
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transform a peptide to SpecGlob spectrum More...
#include "peptidespectrum.h"
#include "../../peptide/peptidefragmentionlistbase.h"
#include "../../peptide/peptiderawfragmentmasses.h"
Go to the source code of this file.
Namespaces | |
namespace | pappso |
tries to keep as much as possible monoisotopes, removing any possible C13 peaks and changes multicharge peaks to monocharge | |
namespace | pappso::specglob |
transform a peptide to SpecGlob spectrum
C++ implementation of the SpecGlob algorithm described in :
Prunier, G. et al. Fast alignment of mass spectra in large proteomics datasets, capturing dissimilarities arising from multiple complex modifications of peptides. BMC Bioinformatics 24, 421 (2023).
HAL Id : hal-04296170 , version 1 Mot de passe : hxo20cl DOI : 10.1186/s12859-023-05555-y
Definition in file peptidespectrum.cpp.