GNPSMGFFile.h

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//                   OpenMS -- Open-Source Mass Spectrometry
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// Copyright The OpenMS Team -- Eberhard Karls University Tuebingen,
// ETH Zurich, and Freie Universitaet Berlin 2002-2023.
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// $Maintainer: Dorrestein Lab - University of California San Diego - https://dorresteinlab.ucsd.edu/$
// $Authors: Abinesh Sarvepalli and Louis Felix Nothias$
// $Contributors: Fabian Aicheler and Oliver Alka from Oliver Kohlbacher's group at Tubingen University$
 
#pragma once
 
#include <OpenMS/DATASTRUCTURES/DefaultParamHandler.h>
#include <OpenMS/COMPARISON/SPECTRA/BinnedSpectrum.h>
#include <OpenMS/CONCEPT/ProgressLogger.h>
 
namespace OpenMS
{
  class OPENMS_DLLAPI GNPSMGFFile : 
    public DefaultParamHandler,
    public ProgressLogger
  {
    public:
      // default c'tor
      GNPSMGFFile();
 
      // see GNPSExport tool documentation
      void store(const String& consensus_file_path, const StringList& mzml_file_paths, const String& out) const;
 
    private:
      static constexpr double DEF_COSINE_SIMILARITY = 0.9;
      static constexpr double DEF_MERGE_BIN_SIZE = static_cast<double>(BinnedSpectrum::DEFAULT_BIN_WIDTH_HIRES);
 
//      static constexpr double DEF_PREC_MASS_TOL = 0.5;
//      static constexpr bool DEF_PREC_MASS_TOL_ISPPM = false;
 
      static constexpr int DEF_PEPT_CUTOFF = 5;
      static constexpr int DEF_MSMAP_CACHE = 50;
  };
}