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  • src/unittests/AnalysisCorrelationToPointUnitTest.cpp

    rd74077 re5c0a1  
    4646
    4747  // construct element list
    48   std::vector<element *> elements;
     48  std::vector<const element *> elements;
    4949  hydrogen = World::getInstance().getPeriode()->FindElement(1);
    5050  CPPUNIT_ASSERT(hydrogen != NULL && "hydrogen element not found");
     
    5353  TestMolecule = World::getInstance().createMolecule();
    5454  Walker = World::getInstance().createAtom();
    55   Walker->setType(hydrogen);
    56   Walker->setPosition(Vector(1., 0., 1. ));
     55  Walker->type = hydrogen;
     56  *Walker->node = Vector(1., 0., 1. );
    5757  TestMolecule->AddAtom(Walker);
    5858  Walker = World::getInstance().createAtom();
    59   Walker->setType(hydrogen);
    60   Walker->setPosition(Vector(0., 1., 1. ));
     59  Walker->type = hydrogen;
     60  *Walker->node = Vector(0., 1., 1. );
    6161  TestMolecule->AddAtom(Walker);
    6262  Walker = World::getInstance().createAtom();
    63   Walker->setType(hydrogen);
    64   Walker->setPosition(Vector(1., 1., 0. ));
     63  Walker->type = hydrogen;
     64  *Walker->node = Vector(1., 1., 0. );
    6565  TestMolecule->AddAtom(Walker);
    6666  Walker = World::getInstance().createAtom();
    67   Walker->setType(hydrogen);
    68   Walker->setPosition(Vector(0., 0., 0. ));
     67  Walker->type = hydrogen;
     68  *Walker->node = Vector(0., 0., 0. );
    6969  TestMolecule->AddAtom(Walker);
    7070
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