Fix_FitPartialCharges
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Last change
on this file since eaf08f was 9b5a2c, checked in by Frederik Heber <heber@…>, 14 years ago |
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Moved analysis modules into subfolder Analysis along with its unit tests.
- new Makefiles are included in src/Makefile.am and src/unittests/Makefile.am.
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Property mode
set to
100644
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File size:
1.0 KB
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| 1 | /*
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| 2 | * AnalysisBondsUnitTest.hpp
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| 3 | *
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| 4 | * Created on: Nov 7, 2009
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| 5 | * Author: heber
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| 6 | */
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| 7 |
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| 8 | #ifndef ANALYSISBONDSUNITTEST_HPP_
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| 9 | #define ANALYSISBONDSUNITTEST_HPP_
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| 10 |
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| 11 | // include config.h
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| 12 | #ifdef HAVE_CONFIG_H
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| 13 | #include <config.h>
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| 14 | #endif
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| 15 |
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| 16 |
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| 17 | #include <cppunit/extensions/HelperMacros.h>
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| 18 |
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| 19 | class BondGraph;
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| 20 | class element;
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| 21 | class molecule;
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| 22 | class periodentafel;
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| 23 |
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| 24 | /********************************************** Test classes **************************************/
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| 25 |
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| 26 | class AnalysisBondsTest : public CppUnit::TestFixture
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| 27 | {
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| 28 | CPPUNIT_TEST_SUITE( AnalysisBondsTest) ;
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| 29 | CPPUNIT_TEST ( GetMaxMinMeanBondCountTest );
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| 30 | CPPUNIT_TEST ( MinMeanMaxBondDistanceBetweenElementsTest );
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| 31 | CPPUNIT_TEST_SUITE_END();
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| 32 |
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| 33 | public:
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| 34 | void setUp();
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| 35 | void tearDown();
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| 36 | void GetMaxMinMeanBondCountTest();
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| 37 | void MinMeanMaxBondDistanceBetweenElementsTest();
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| 38 |
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| 39 | private:
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| 40 |
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| 41 | molecule *TestMolecule;
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| 42 | const element *hydrogen;
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| 43 | const element *carbon;
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| 44 |
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| 45 | BondGraph *BG;
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| 46 | string *filename;
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| 47 | };
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| 48 |
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| 49 | #endif /* ANALYSISBONDSUNITTEST_HPP_ */
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