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

File:

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

src/unittests/AnalysisPairCorrelationUnitTest.cpp

@@ -47 +47 @@
   binmap = NULL;
 
-  // construct element list
-  std::vector<element *> elements;
+  // construct molecule (tetraeder of hydrogens)
   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)
   TestMolecule = World::getInstance().createMolecule();
   Walker = World::getInstance().createAtom();
@@ -74 +68 @@
 
   // check that TestMolecule was correctly constructed
-  CPPUNIT_ASSERT_EQUAL( TestMolecule->getAtomCount(), 4 );
+  CPPUNIT_ASSERT_EQUAL( TestMolecule->AtomCount, 4 );
 
   TestList = World::getInstance().getMolecules();
@@ -81 +75 @@
 
   // init maps
-  correlationmap = PairCorrelation( TestList, elements);
+  correlationmap = PairCorrelation( TestList, hydrogen, hydrogen );
   binmap = NULL;