text: // --------------------------------------------------------------------------
  //                   OpenMS -- Open-Source Mass Spectrometry               
  // --------------------------------------------------------------------------
  // Copyright The OpenMS Team -- Eberhard Karls University Tuebingen,
  // ETH Zurich, and Freie Universitaet Berlin 2002-2018.
  // 
  // This software is released under a three-clause BSD license:
  //  * Redistributions of source code must retain the above copyright
  //    notice, this list of conditions and the following disclaimer.
  //  * Redistributions in binary form must reproduce the above copyright
  //    notice, this list of conditions and the following disclaimer in the
  //    documentation and/or other materials provided with the distribution.
  //  * Neither the name of any author or any participating institution 
  //    may be used to endorse or promote products derived from this software 
  //    without specific prior written permission.
  // For a full list of authors, refer to the file AUTHORS. 
  // --------------------------------------------------------------------------
  // THIS SOFTWARE IS PROVIDED BY THE COPYRIGHT HOLDERS AND CONTRIBUTORS "AS IS"
  // AND ANY EXPRESS OR IMPLIED WARRANTIES, INCLUDING, BUT NOT LIMITED TO, THE
  // IMPLIED WARRANTIES OF MERCHANTABILITY AND FITNESS FOR A PARTICULAR PURPOSE
  // ARE DISCLAIMED. IN NO EVENT SHALL ANY OF THE AUTHORS OR THE CONTRIBUTING 
  // INSTITUTIONS BE LIABLE FOR ANY DIRECT, INDIRECT, INCIDENTAL, SPECIAL, 
  // EXEMPLARY, OR CONSEQUENTIAL DAMAGES (INCLUDING, BUT NOT LIMITED TO, 
  // PROCUREMENT OF SUBSTITUTE GOODS OR SERVICES; LOSS OF USE, DATA, OR PROFITS; 
  // OR BUSINESS INTERRUPTION) HOWEVER CAUSED AND ON ANY THEORY OF LIABILITY, 
  // WHETHER IN CONTRACT, STRICT LIABILITY, OR TORT (INCLUDING NEGLIGENCE OR 
  // OTHERWISE) ARISING IN ANY WAY OUT OF THE USE OF THIS SOFTWARE, EVEN IF 
  // ADVISED OF THE POSSIBILITY OF SUCH DAMAGE.
  // 
  // --------------------------------------------------------------------------
  // $Maintainer: Timo Sachsenberg $
  // $Authors: Andreas Bertsch $
  // --------------------------------------------------------------------------
  
  #include <OpenMS/CONCEPT/ClassTest.h>
  #include <OpenMS/test_config.h>
  
  ///////////////////////////
  #include <OpenMS/CHEMISTRY/MASSDECOMPOSITION/MassDecompositionAlgorithm.h>
  #include <OpenMS/CHEMISTRY/AASequence.h>
  ///////////////////////////
  
  using namespace OpenMS;
  using namespace std;
  
  START_TEST(MassDecompositionAlgorithm, "$Id$")
  
  /////////////////////////////////////////////////////////////
  /////////////////////////////////////////////////////////////
  
  MassDecompositionAlgorithm* ptr = nullptr;
  MassDecompositionAlgorithm* nullPointer = nullptr;
  START_SECTION(MassDecompositionAlgorithm())
  {
    ptr = new MassDecompositionAlgorithm();
    TEST_NOT_EQUAL(ptr, nullPointer)
  }
  END_SECTION
  
  START_SECTION(virtual ~MassDecompositionAlgorithm())
  {
    delete ptr;
  }
  END_SECTION
  
  START_SECTION((void getDecompositions(std::vector<MassDecomposition>& decomps, double weight)))
  {
    vector<MassDecomposition> decomps;
    double mass = AASequence::fromString("DFPIANGER").getMonoWeight(Residue::Internal);
    cerr << mass << endl;
  
    MassDecompositionAlgorithm mda;
    Param p(mda.getParameters());
    p.setValue("tolerance", 0.0001);
    mda.setParameters(p);
  
    mda.getDecompositions(decomps, mass);
    TEST_EQUAL(decomps.size(), 842)
  
    p.setValue("tolerance", 0.001);
    mda.setParameters(p);
    decomps.clear();
    mda.getDecompositions(decomps, mass);
    TEST_EQUAL(decomps.size(), 911);
  }
  END_SECTION
  
  
  /////////////////////////////////////////////////////////////
  /////////////////////////////////////////////////////////////
  END_TEST
  
  
  
  