apoCHARMM 1.0.0
High-performance molecular dynamics simulations on GPUs
 
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DistanceRestraintForce< AT, CT > Member List

This is the complete list of members for DistanceRestraintForce< AT, CT >, including all inherited members.

addRestraint(const std::vector< std::array< AtomReference, 2 > > &atomReferencePairs, const std::vector< double > &coefficients, const double forceConstant, const double referenceValue, const int distanceExponent, const int energyExponent, const DistanceRestraintCondition condition=DistanceRestraintCondition::NONE)DistanceRestraintForce< AT, CT >
calcForce(const float4 *xyzq, const bool calcEnergy, const bool calcVirial)DistanceRestraintForce< AT, CT >
clear(void)DistanceRestraintForce< AT, CT >
contributesVirialDistanceRestraintForce< AT, CT >static
DistanceRestraintForce(void)=deleteDistanceRestraintForce< AT, CT >
DistanceRestraintForce(const int numAtoms)DistanceRestraintForce< AT, CT >
DistanceRestraintForce(const DistanceRestraintForce &other)=deleteDistanceRestraintForce< AT, CT >
DistanceRestraintForce(DistanceRestraintForce &&other)=deleteDistanceRestraintForce< AT, CT >
getEnergyVirial(void)DistanceRestraintForce< AT, CT >
getForce(void)DistanceRestraintForce< AT, CT >
getStream(void)DistanceRestraintForce< AT, CT >
initialize(const int numAtoms, const std::vector< double > &boxDimensions)DistanceRestraintForce< AT, CT >
operator=(const DistanceRestraintForce &other)=deleteDistanceRestraintForce< AT, CT >
operator=(DistanceRestraintForce &&other)=deleteDistanceRestraintForce< AT, CT >
reset(void)DistanceRestraintForce< AT, CT >
setBoxDimensions(const std::vector< double > &boxDimensions)DistanceRestraintForce< AT, CT >
setScale(const double scale)DistanceRestraintForce< AT, CT >
~DistanceRestraintForce(void) noexceptDistanceRestraintForce< AT, CT >