Changes in src/unittests/AnalysisPairCorrelationUnitTest.cpp [920c70:c78d44]

File:

• src/unittests/AnalysisPairCorrelationUnitTest.cpp (modified) (3 diffs)

src/unittests/AnalysisPairCorrelationUnitTest.cpp

@@ -47 +47 @@
   binmap = NULL;
 
+  // construct element list
+  std::vector<element *> elements;
+  hydrogen = World::getInstance().getPeriode()->FindElement(1);
+  CPPUNIT_ASSERT(hydrogen != NULL && "hydrogen element not found");
+  elements.push_back(hydrogen);
+  elements.push_back(hydrogen);
+
   // construct molecule (tetraeder of hydrogens)
-  hydrogen = World::getInstance().getPeriode()->FindElement(1);
   TestMolecule = World::getInstance().createMolecule();
   Walker = World::getInstance().createAtom();
@@ -68 +74 @@
 
   // check that TestMolecule was correctly constructed
-  CPPUNIT_ASSERT_EQUAL( TestMolecule->AtomCount, 4 );
+  CPPUNIT_ASSERT_EQUAL( TestMolecule->getAtomCount(), 4 );
 
   TestList = World::getInstance().getMolecules();
@@ -75 +81 @@
 
   // init maps
-  correlationmap = PairCorrelation( TestList, hydrogen, hydrogen );
+  correlationmap = PairCorrelation( TestList, elements);
   binmap = NULL;