RigidUnit Class Reference

#include <CompoundModeler.h>

List of all members.

Public Member Functions
	RigidUnit (RigidUnitIndex ix, CompoundModeler &parent)
MassProperties	calcMassProperties () const
RigidUnit &	setMobilizedBodyIndex (MobilizedBodyIndex ix)
void	buildUp (AtomSubsystem::AtomIndex seedAtomIx, CompoundRep &compoundRep)
Public Attributes
RigidUnitIndex	parentId
Compound::BondCenterIndex	inboardBondCenterIndex
Angle	inboardBondDihedralAngle
Transform	frameInTopCompoundFrame
Transform	frameInParentFrame
CompoundModeler *	compoundModeler
MobilizedBodyIndex	bodyIx
RigidUnitIndex	myIndex
Compound::BondIndex	inboardBondIndex
std::set < AtomSubsystem::AtomIndex >	clusterAtoms

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Constructor & Destructor Documentation

RigidUnit	(	RigidUnitIndex	ix,
		CompoundModeler &	parent
	)			[inline]

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Member Function Documentation

void buildUp	(	AtomSubsystem::AtomIndex	seedAtomIx,
		CompoundRep &	compoundRep
	)

MassProperties calcMassProperties

(

)

const [inline]

References Atom::getMass(), and Atom::getStationInBodyFrame().

RigidUnit& setMobilizedBodyIndex

(

MobilizedBodyIndex

ix

)

[inline]

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Member Data Documentation

MobilizedBodyIndex bodyIx

std::set<AtomSubsystem::AtomIndex> clusterAtoms

CompoundModeler* compoundModeler

Transform frameInParentFrame

Transform frameInTopCompoundFrame

Compound::BondCenterIndex inboardBondCenterIndex

Angle inboardBondDihedralAngle

Compound::BondIndex inboardBondIndex

RigidUnitIndex myIndex

RigidUnitIndex parentId

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

• CompoundModeler.h