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// -*- Mode: C++; tab-width: 2; -*-
// vi: set ts=2:
//
#include <BALL/CONCEPT/classTest.h>
#include <BALLTestConfig.h>
///////////////////////////
#include <BALL/STRUCTURE/connectedComponentsProcessor.h>
#include <BALL/FORMAT/MOL2File.h>
#include <BALL/KERNEL/system.h>
///////////////////////////
using namespace BALL;
START_TEST(ConnectedComponentsProcessor)
PRECISION(1e-5)
/////////////////////////////////////////////////////////////
/////////////////////////////////////////////////////////////
ConnectedComponentsProcessor* ccp;
CHECK(ConnectedComponentsProcessor())
ccp = new ConnectedComponentsProcessor();
TEST_NOT_EQUAL(ccp,0)
RESULT
CHECK(~ConnectedComponentsProcessor())
delete ccp;
RESULT
CHECK( operator() )
ConnectedComponentsProcessor ccp;
System sys;
MOL2File mol(BALL_TEST_DATA_PATH(ConnectedComponentsProcessor_test.mol2), std::ios::in);
mol >> sys;
sys.apply(ccp);
RESULT
//New
CHECK( applied on empty System )
ConnectedComponentsProcessor ccp;
System sys;
sys.apply(ccp);
TEST_EQUAL(ccp.getNumberOfConnectedComponents(), 0)
ccp.splitIntoMolecules(sys);
ConnectedComponentsProcessor::ComponentVector components = ccp.getComponents();
TEST_EQUAL(components.size(), 0)
RESULT
CHECK( getNumberOfConnectedComponents() )
ConnectedComponentsProcessor ccp;
System sys;
MOL2File mol(BALL_TEST_DATA_PATH(ConnectedComponentsProcessor_test.mol2), std::ios::in);
mol >> sys;
sys.apply(ccp);
TEST_EQUAL(ccp.getNumberOfConnectedComponents(), 2)
RESULT
CHECK( splitIntoMolecules() )
ConnectedComponentsProcessor ccp;
System sys;
MOL2File mol(BALL_TEST_DATA_PATH(ConnectedComponentsProcessor_test.mol2), std::ios::in);
mol >> sys;
sys.apply(ccp);
ccp.splitIntoMolecules(sys);
for (MoleculeIterator m_it = sys.beginMolecule(); +m_it; ++m_it)
{
TEST_EQUAL(m_it->countAtoms(), 10)
}
RESULT
CHECK( splitIntoMolecules() twice )
ConnectedComponentsProcessor ccp;
System sys;
MOL2File mol(BALL_TEST_DATA_PATH(ConnectedComponentsProcessor_test.mol2), std::ios::in);
mol >> sys;
sys.apply(ccp);
ccp.splitIntoMolecules(sys);
sys.apply(ccp);
ccp.splitIntoMolecules(sys);
for (MoleculeIterator m_it = sys.beginMolecule(); +m_it; ++m_it)
{
TEST_EQUAL(m_it->countAtoms(), 10)
}
RESULT
CHECK( getComponents() )
ConnectedComponentsProcessor ccp;
System sys;
MOL2File mol(BALL_TEST_DATA_PATH(ConnectedComponentsProcessor_test.mol2), std::ios::in);
mol >> sys;
sys.apply(ccp);
ccp.splitIntoMolecules(sys);
ConnectedComponentsProcessor::ComponentVector components = ccp.getComponents();
TEST_EQUAL(components.size(), 2)
TEST_EQUAL(components[0].size(), 10)
RESULT
/////////////////////////////////////////////////////////////
/////////////////////////////////////////////////////////////
END_TEST
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