source: src/Descriptors/unittests/AtomDescriptorUnitTest.hpp@ ac9dc8

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Last change on this file since ac9dc8 was 61c364, checked in by Frederik Heber <heber@…>, 13 years ago

Added AtomOrderDescription along with SelectionAtomByOrder.
  • Property mode set to 100644
File size: 1.1 KB
RevLine 
[7a1ce5]1/*
[d766b5]2 * AtomDescriptorUnitTest.hpp
[7a1ce5]3 *
4 * Created on: Feb 9, 2010
5 * Author: crueger
6 */
7
[d766b5]8#ifndef ATOMDESCRIPTORUNITTEST_HPP_
9#define ATOMDESCRIPTORUNITTEST_HPP_
[7a1ce5]10
[56f73b]11// include config.h
12#ifdef HAVE_CONFIG_H
13#include <config.h>
14#endif
15
16
[7a1ce5]17#include <cppunit/extensions/HelperMacros.h>
18
[ead4e6]19#include "types.hpp"
[57adc7]20
[88b400]21// we prefer enum over define
22enum { ATOM_COUNT = 10 };
[7a1ce5]23
24class atom;
25
[57adc7]26class AtomDescriptorTest : public CppUnit::TestFixture
[7a1ce5]27{
[57adc7]28 CPPUNIT_TEST_SUITE( AtomDescriptorTest );
[7a1ce5]29 CPPUNIT_TEST ( AtomBaseSetsTest );
30 CPPUNIT_TEST ( AtomIdTest );
[b49568]31 CPPUNIT_TEST ( AtomOfMoleculeTest );
[61c364]32 CPPUNIT_TEST ( AtomOrderTest );
[bbab87]33 CPPUNIT_TEST ( AtomsWithinDistanceOfTest );
[61c364]34// CPPUNIT_TEST ( AtomsShapeTest );
[7a1ce5]35 CPPUNIT_TEST ( AtomCalcTest );
36 CPPUNIT_TEST_SUITE_END();
37
38public:
39 void setUp();
40 void tearDown();
41
42 void AtomBaseSetsTest();
43 void AtomIdTest();
[61c364]44 void AtomOfMoleculeTest();
45 void AtomOrderTest();
[bbab87]46 void AtomsWithinDistanceOfTest();
[61c364]47// void AtomsShapeTest();
[7a1ce5]48 void AtomCalcTest();
49
50private:
51 atom *atoms [ATOM_COUNT];
[57adc7]52 atomId_t atomIds [ATOM_COUNT];
[7a1ce5]53};
54
[d766b5]55#endif /* ATOMDESCRIPTORUNITTEST_HPP_ */
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