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AdjacencyListUnitTest.hpp@ 02f14d

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Candidate_v1.7.0 stable

Last change on this file since 02f14d was 3aa8a5, checked in by Frederik Heber <heber@…>, 13 years ago

REFACTOR: AdjacencyList now just contains a single internal map.

map may either be created from world for a given vector of atomids or parsed from file.
Moved molecule::StoreAdjacencyFromFile() over to StoreToFile().
removed atom_bondedparticle::OutputAdjacency().
changed comparison functions into operator<,>,==,!=().
adapted FragmentationAction and SaveAdjacencyAction due to new calls, the former also needs to check the adjacency file for existence.
SaveAdjacencyAction does not split given filename into path and name anymore.
TESTFIX: Fragmentation-MaxOrder is working again, removed XFAIL_IF.
TESTFIX: Rewrite of AdjacencyListUnitTest due to heavily changed interface of AdjacencyList. Also wrongadjacencyfile3 was buggy.
TESTFIX: regression test SaveAdjacency replaced tab by space and removed tab after last entry in test.adj.

File size: 1.1 KB

Line
1	/*
2	* AdjacencyListUnitTest.hpp
3	*
4	* Created on: Oct 17, 2011
5	* Author: heber
6	*/
7
8	#ifndef UNITTEST_HPP_
9	#define UNITTEST_HPP_
10
11	// include config.h
12	#ifdef HAVE_CONFIG_H
13	#include <config.h>
14	#endif
15
16
17	#include <cppunit/extensions/HelperMacros.h>
18
19	#include "Graph/AdjacencyList.hpp"
20	#include "types.hpp"
21
22	// we prefer enum over define
23	enum { ATOM_COUNT = 10 };
24
25	class atom;
26	class molecule;
27	class World;
28
29	class AdjacencyListTest : public CppUnit::TestFixture
30	{
31	CPPUNIT_TEST_SUITE( AdjacencyListTest );
32	CPPUNIT_TEST ( CreateMapTest );
33	CPPUNIT_TEST ( ParseIntoMapTest );
34	CPPUNIT_TEST ( StoreToFileTest );
35	CPPUNIT_TEST ( operatorGreaterLessTest );
36	CPPUNIT_TEST ( operatorEqualTest );
37	CPPUNIT_TEST ( CheckAgainstSubsetTest );
38	CPPUNIT_TEST_SUITE_END();
39
40	public:
41	void setUp();
42	void tearDown();
43
44	void CreateMapTest();
45	void ParseIntoMapTest();
46	void StoreToFileTest();
47	void operatorGreaterLessTest();
48	void operatorEqualTest();
49	void CheckAgainstSubsetTest();
50
51	private:
52	AdjacencyList::AtomBondMap comparisonMap;
53	std::vector<atom *> atoms;
54	std::vector<atomId_t> atomIds;
55	molecule * TestMolecule;
56	};
57
58	#endif /* UNITTEST_HPP_ */

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