OpenMD::HullFinder Class Reference

Inheritance diagram for OpenMD::HullFinder:

Public Member Functions
	HullFinder (SimInfo *si)
SelectionSet	findHull ()
SelectionSet	findHull (int frame)
RealType	getSurfaceArea ()
RealType	getVolume ()

Public Attributes
SimInfo *	info_ {nullptr}
std::vector< StuntDouble * >	stuntdoubles_
std::vector< Bond * >	bonds_
std::vector< Bend * >	bends_
std::vector< Torsion * >	torsions_
std::vector< Inversion * >	inversions_
std::vector< Molecule * >	molecules_
vector< int >	nObjects_
Hull *	surfaceMesh_
RealType	surfaceArea_
RealType	volume_
std::vector< StuntDouble * >	localSites_

Detailed Description

Definition at line 56 of file HullFinder.hpp.

Constructor & Destructor Documentation

HullFinder()

OpenMD::HullFinder::HullFinder

(

SimInfo *

si

)

Definition at line 53 of file HullFinder.cpp.

~HullFinder()

OpenMD::HullFinder::~HullFinder

(

)

Definition at line 145 of file HullFinder.cpp.

Member Function Documentation

findHull() [1/2]

SelectionSet OpenMD::HullFinder::findHull

(

)

Definition at line 151 of file HullFinder.cpp.

findHull() [2/2]

SelectionSet OpenMD::HullFinder::findHull

(

int

frame

)

Definition at line 186 of file HullFinder.cpp.

getSurfaceArea()

RealType OpenMD::HullFinder::getSurfaceArea ( )

inline

Definition at line 63 of file HullFinder.hpp.

getVolume()

RealType OpenMD::HullFinder::getVolume ( )

inline

Definition at line 64 of file HullFinder.hpp.

Member Data Documentation

bends_

std::vector<Bend*> OpenMD::HullFinder::bends_

Definition at line 69 of file HullFinder.hpp.

bonds_

std::vector<Bond*> OpenMD::HullFinder::bonds_

Definition at line 68 of file HullFinder.hpp.

info_

SimInfo* OpenMD::HullFinder::info_ {nullptr}

Definition at line 66 of file HullFinder.hpp.

inversions_

std::vector<Inversion*> OpenMD::HullFinder::inversions_

Definition at line 71 of file HullFinder.hpp.

localSites_

std::vector<StuntDouble*> OpenMD::HullFinder::localSites_

Definition at line 78 of file HullFinder.hpp.

molecules_

std::vector<Molecule*> OpenMD::HullFinder::molecules_

Definition at line 72 of file HullFinder.hpp.

nObjects_

vector<int> OpenMD::HullFinder::nObjects_

Definition at line 73 of file HullFinder.hpp.

stuntdoubles_

std::vector<StuntDouble*> OpenMD::HullFinder::stuntdoubles_

Definition at line 67 of file HullFinder.hpp.

surfaceArea_

RealType OpenMD::HullFinder::surfaceArea_

Definition at line 76 of file HullFinder.hpp.

surfaceMesh_

Hull* OpenMD::HullFinder::surfaceMesh_

Definition at line 75 of file HullFinder.hpp.

torsions_

std::vector<Torsion*> OpenMD::HullFinder::torsions_

Definition at line 70 of file HullFinder.hpp.

volume_

RealType OpenMD::HullFinder::volume_

Definition at line 77 of file HullFinder.hpp.

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

• selection/HullFinder.hpp
• selection/HullFinder.cpp