AppTest.cpp File Reference

#include "../App/AppUtils/Tasks.h"
#include "Files/tests_file_location.h"
#include "TestUtilities/MockQmCalculator.h"
#include <Core/Log.h>
#include <Core/ModuleManager.h>
#include <Swoose/MMParametrization/MMParametrizationSettings.h>
#include <Swoose/MMParametrization/Parametrizer.h>
#include <Swoose/MolecularMechanics/SFAM/SfamCalculatorSettings.h>
#include <Swoose/MolecularMechanics/SFAM/SfamMolecularMechanicsCalculator.h>
#include <Swoose/QMMM/QmmmCalculator.h>
#include <Swoose/QMMM/QmmmCalculatorSettings.h>
#include <Swoose/StructurePreparation/StructurePreparationData.h>
#include <Swoose/StructurePreparation/StructurePreparationSettings.h>
#include <Swoose/StructurePreparation/StructureProcessor.h>
#include <Utils/GeometryOptimization/QmmmGeometryOptimizer.h>
#include <Utils/IO/ChemicalFileFormats/ChemicalFileHandler.h>
#include <Utils/IO/ChemicalFileFormats/OpenBabelStreamHandler.h>
#include <Utils/IO/NativeFilenames.h>
#include <Utils/MolecularDynamics/MolecularDynamics.h>
#include <Utils/MolecularDynamics/MolecularDynamicsSettings.h>
#include <gmock/gmock.h>
#include <yaml-cpp/yaml.h>

Include dependency graph for AppTest.cpp:

Classes
class	Scine::Tests::AppTest
	Tests the functionality of task handlers applied in the app. It basically just tests whether the tasks run through normally without throwing exceptions. The correctness of results is tested individually for the classes that do the work in other tests. More...

Functions
	Scine::Tests::TEST_F (AppTest, TaskForSFAMCalculationWorks)
	Scine::Tests::TEST_F (AppTest, TaskForSFAMParametrizationWorksWithOrca)
	Scine::Tests::TEST_F (AppTest, TaskForSFAMParametrizationWorksWithTurbomole)
	Scine::Tests::TEST_F (AppTest, TaskForClassicalMolecularDynamicsWorks)
	Scine::Tests::TEST_F (AppTest, TaskForHybridMolecularDynamicsWorks)
	Scine::Tests::TEST_F (AppTest, TaskForQmmmWorks)
	Scine::Tests::TEST_F (AppTest, TaskForSFAMOptimizationWorks)
	Scine::Tests::TEST_F (AppTest, TaskForQmmmOptimizationWorks)
	Scine::Tests::TEST_F (AppTest, TaskForStructurePreparationWorks)

Detailed Description

Copyright

This code is licensed under the 3-clause BSD license.
Copyright ETH Zurich, Department of Chemistry and Applied Biosciences, Reiher Group.
See LICENSE.txt for details.