Rosetta 3.4
|
#include <ResidualDipolarCouplingEnergy_Rohl.hh>
Public Types | |
typedef WholeStructureEnergy | parent |
Public Member Functions | |
ResidualDipolarCouplingEnergy_Rohl () | |
virtual EnergyMethodOP | clone () const |
void | finalize_total_energy (pose::Pose &pose, ScoreFunction const &, EnergyMap &totals) const |
called by the ScoreFunction at the end of energy evaluation. The derived class has the opportunity to accumulate a score into the pose's total_energy EnergyMap. WholeStructure energies operate within this method; any method using a NeighborList during minimization would also operate within this function call. | |
void | indicate_required_context_graphs (utility::vector1< bool > &) const |
Indicate in the context-graphs-required list which context-graphs this energy method requires that the Pose maintain when doing neighbor evaluation. Context graphs are allowed. |
Reimplemented from core::scoring::methods::WholeStructureEnergy.
core::scoring::methods::ResidualDipolarCouplingEnergy_Rohl::ResidualDipolarCouplingEnergy_Rohl | ( | ) |
Referenced by clone().
EnergyMethodOP core::scoring::methods::ResidualDipolarCouplingEnergy_Rohl::clone | ( | ) | const [virtual] |
Implements core::scoring::methods::EnergyMethod.
References ResidualDipolarCouplingEnergy_Rohl().
void core::scoring::methods::ResidualDipolarCouplingEnergy_Rohl::finalize_total_energy | ( | pose::Pose & | pose, |
ScoreFunction const & | sfxn, | ||
EnergyMap & | total_energy | ||
) | const [virtual] |
called by the ScoreFunction at the end of energy evaluation. The derived class has the opportunity to accumulate a score into the pose's total_energy EnergyMap. WholeStructure energies operate within this method; any method using a NeighborList during minimization would also operate within this function call.
called at the end of energy evaluation
Reimplemented from core::scoring::methods::EnergyMethod.
References core::scoring::rdc_rohl.
void core::scoring::methods::ResidualDipolarCouplingEnergy_Rohl::indicate_required_context_graphs | ( | utility::vector1< bool > & | context_graphs_required | ) | const [inline, virtual] |
Indicate in the context-graphs-required list which context-graphs this energy method requires that the Pose maintain when doing neighbor evaluation. Context graphs are allowed.
Implements core::scoring::methods::EnergyMethod.