OpenMD 3.2
Molecular Dynamics in the Open
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OpenMD::ObjectCount Class Reference
Inheritance diagram for OpenMD::ObjectCount:

Public Member Functions

 ObjectCount (SimInfo *info, const std::string &filename, const std::string &sele)
virtual void process ()
Public Member Functions inherited from OpenMD::StaticAnalyser
 StaticAnalyser (SimInfo *info, const std::string &filename, unsigned int nbins)
void setOutputName (const std::string &filename)
const std::string & getOutputFileName () const
void setStep (int step)
int getStep () const
const std::string & getAnalysisType () const
void setAnalysisType (const std::string &type)
void setParameterString (const std::string &params)

Protected Member Functions

void writeCounts ()
Protected Member Functions inherited from OpenMD::StaticAnalyser
virtual void writeOutput ()

Protected Attributes

Snapshot * currentSnapshot_
vector< int > counts_
RealType nAvg
RealType n2Avg
RealType sDev
std::string selectionScript_
SelectionManager seleMan_
SelectionEvaluator evaluator_
Protected Attributes inherited from OpenMD::StaticAnalyser
SimInfo * info_ {nullptr}
std::string dumpFilename_
int step_
unsigned int nBins_
std::string outputFilename_
std::string analysisType_
std::string paramString_
std::vector< OutputData > data_
std::vector< AtomType * > outputTypes_

Detailed Description

Definition at line 58 of file ObjectCount.hpp.

Constructor & Destructor Documentation

◆ ObjectCount()

OpenMD::ObjectCount::ObjectCount ( SimInfo * info,
const std::string & filename,
const std::string & sele )

Definition at line 60 of file ObjectCount.cpp.

Member Function Documentation

◆ process()

void OpenMD::ObjectCount::process ( )
virtual

Implements OpenMD::StaticAnalyser.

Definition at line 73 of file ObjectCount.cpp.

◆ writeCounts()

void OpenMD::ObjectCount::writeCounts ( )
protected

Definition at line 107 of file ObjectCount.cpp.

Member Data Documentation

◆ counts_

vector<int> OpenMD::ObjectCount::counts_
protected

Definition at line 69 of file ObjectCount.hpp.

◆ currentSnapshot_

Snapshot* OpenMD::ObjectCount::currentSnapshot_
protected

Definition at line 67 of file ObjectCount.hpp.

◆ evaluator_

SelectionEvaluator OpenMD::ObjectCount::evaluator_
protected

Definition at line 76 of file ObjectCount.hpp.

◆ n2Avg

RealType OpenMD::ObjectCount::n2Avg
protected

Definition at line 71 of file ObjectCount.hpp.

◆ nAvg

RealType OpenMD::ObjectCount::nAvg
protected

Definition at line 70 of file ObjectCount.hpp.

◆ sDev

RealType OpenMD::ObjectCount::sDev
protected

Definition at line 72 of file ObjectCount.hpp.

◆ selectionScript_

std::string OpenMD::ObjectCount::selectionScript_
protected

Definition at line 74 of file ObjectCount.hpp.

◆ seleMan_

SelectionManager OpenMD::ObjectCount::seleMan_
protected

Definition at line 75 of file ObjectCount.hpp.

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