votca 2025.1-dev
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CsgParallelTestApp Class Reference
Inheritance diagram for CsgParallelTestApp:
Collaboration diagram for CsgParallelTestApp:

Protected Attributes

votca::tools::Histogram rdf_
double cut_off_
Protected Attributes inherited from votca::csg::CsgApplication
std::list< CGObserver * > observers_
bool do_mapping_
std::vector< std::unique_ptr< Worker > > myWorkers_
Index nframes_
bool is_first_frame_
Index nthreads_
tools::Mutex nframesMutex_
tools::Mutex traj_readerMutex_
std::vector< std::unique_ptr< tools::Mutex > > threadsMutexesIn_
 stores Mutexes used to impose order for input
std::vector< std::unique_ptr< tools::Mutex > > threadsMutexesOut_
 stores Mutexes used to impose order for output
std::unique_ptr< TrajectoryReadertraj_reader_
Protected Attributes inherited from votca::tools::Application
std::map< std::string, boost::program_options::options_description > op_groups_
bool continue_execution_ = true

Private Member Functions

string ProgramName () override
 program name
void HelpText (ostream &out) override
 help text of application without version information
void Initialize () override
 Initialize application data.
bool DoTrajectory () override
 overload and return true to enable trajectory command line options
bool DoThreaded () override
void BeginEvaluate (Topology *top, Topology *top_ref) override
 called before the first frame
void EndEvaluate () override
 called after the last frame
std::unique_ptr< CsgApplication::WorkerForkWorker (void) override
void MergeWorker (Worker *worker) override

Additional Inherited Members

Public Member Functions inherited from votca::csg::CsgApplication
 CsgApplication ()=default
 ~CsgApplication () override=default
bool EvaluateOptions () override
 Process command line options.
void Run (void) override
 Main body of application.
void ShowHelpText (std::ostream &out) override
virtual bool DoMapping (void)
 overload and return true to enable mapping command line options
virtual bool DoMappingDefault (void)
 if DoMapping is true, will by default require mapping or not
virtual bool SynchronizeThreads (void)
virtual bool NeedsTopology (void)
 if topology is always needed
virtual bool EvaluateTopology (Topology *, Topology *=nullptr)
 called after topology was loaded
void AddObserver (CGObserver *observer)
virtual void EvalConfiguration (Topology *top, Topology *top_ref=nullptr)
bool ProcessData (Worker *worker)
 Gets frames from TrajectoryReader in an ordered way and, if successful, calls Worker::EvalConfiguration for that frame.
Public Member Functions inherited from votca::tools::Application
 Application ()
virtual ~Application ()
int Exec (int argc, char **argv)
 executes the program
virtual std::string VersionString ()
 version string of application
void CheckRequired (const std::string &option_name, const std::string &error_msg="")
 Check weather required option is set.
boost::program_options::options_description_easy_init AddProgramOptions (const std::string &group="")
 add option for command line
boost::program_options::variables_map & OptionsMap ()
 get available program options & descriptions
boost::program_options::options_description & OptionsDesc ()
boost::program_options::options_description & VisibleOptions ()
 filters out the Hidden group from the options descriptions
void StopExecution ()
 call StopExecution after EvaluateOptions

Detailed Description

Definition at line 40 of file template_threaded.cc.

Member Function Documentation

◆ BeginEvaluate()

void CsgParallelTestApp::BeginEvaluate ( Topology * top,
Topology * top_ref )
overrideprivatevirtual

called before the first frame

Reimplemented from votca::csg::CsgApplication.

Definition at line 108 of file template_threaded.cc.

◆ DoThreaded()

bool CsgParallelTestApp::DoThreaded ( void )
inlineoverrideprivatevirtual

Reimplemented from votca::csg::CsgApplication.

Definition at line 62 of file template_threaded.cc.

◆ DoTrajectory()

bool CsgParallelTestApp::DoTrajectory ( void )
inlineoverrideprivatevirtual

overload and return true to enable trajectory command line options

Reimplemented from votca::csg::CsgApplication.

Definition at line 50 of file template_threaded.cc.

◆ EndEvaluate()

void CsgParallelTestApp::EndEvaluate ( )
overrideprivatevirtual

called after the last frame

Reimplemented from votca::csg::CsgApplication.

Definition at line 167 of file template_threaded.cc.

◆ ForkWorker()

std::unique_ptr< CsgApplication::Worker > CsgParallelTestApp::ForkWorker ( void )
overrideprivatevirtual

User is required to overload ForkWorker and initialize workers.

Returns
worker

Reimplemented from votca::csg::CsgApplication.

Definition at line 117 of file template_threaded.cc.

◆ HelpText()

void CsgParallelTestApp::HelpText ( ostream & out)
inlineoverrideprivatevirtual

help text of application without version information

Parameters
outostream for output

Implements votca::tools::Application.

Definition at line 44 of file template_threaded.cc.

◆ Initialize()

void CsgParallelTestApp::Initialize ( )
overrideprivatevirtual

Initialize application data.

Initialize is called by run before parsing the command line. All necessary command line arguments can be added here

Reimplemented from votca::csg::CsgApplication.

Definition at line 101 of file template_threaded.cc.

◆ MergeWorker()

void CsgParallelTestApp::MergeWorker ( Worker * worker)
overrideprivatevirtual

User is required to overload MergeWorker and merge data from each worker.

Parameters
worker

Reimplemented from votca::csg::CsgApplication.

Definition at line 140 of file template_threaded.cc.

◆ ProgramName()

string CsgParallelTestApp::ProgramName ( )
inlineoverrideprivatevirtual

program name

Returns
string with program name

overload this function to set the program name

Implements votca::tools::Application.

Definition at line 42 of file template_threaded.cc.

Member Data Documentation

◆ cut_off_

double CsgParallelTestApp::cut_off_
protected

Definition at line 81 of file template_threaded.cc.

◆ rdf_

votca::tools::Histogram CsgParallelTestApp::rdf_
protected

Definition at line 80 of file template_threaded.cc.


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