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gmx::test::anonymous_namespace{simple_mdrun.cpp}::SimpleMdrunTest Class Reference
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Description

Test fixture base for simple mdrun systems.

This test ensures mdrun can run a simulation, reaching reproducible energies.

The choices for tolerance are arbitrary but sufficient.

Additional Inherited Members

- Static Public Member Functions inherited from gmx::test::MdrunTestFixtureBase
static void SetUpTestSuite ()
 Per-test-case setup for lengthy processes that need run only once.
 
static void TearDownTestSuite ()
 Per-test-case tear down.
 
- Public Attributes inherited from gmx::test::MdrunTestFixture
TestFileManager fileManager_
 Manages temporary files during the test.
 
SimulationRunner runner_
 Helper object to manage the preparation for and call of mdrun.
 
- Static Public Attributes inherited from gmx::test::MdrunTestFixtureBase
static MPI_Comm s_communicator = MPI_COMM_NULL
 Communicator over which the test fixture works.
 
static std::unique_ptr
< gmx_hw_info_t > 
s_hwinfo
 Hardware information object. More...
 

The documentation for this class was generated from the following file: