__pad0__ | core::scoring::geometric_solvation::ExactOccludedHbondSolEnergy | |
atom_type_set_ptr_ | core::scoring::geometric_solvation::ExactOccludedHbondSolEnergy | private |
atomic_interaction_cutoff() const | core::scoring::geometric_solvation::ExactOccludedHbondSolEnergy | virtual |
clone() const | core::scoring::geometric_solvation::ExactOccludedHbondSolEnergy | virtual |
compute_grid_constant(hbonds::HBEvalTuple const &hbond_eval_type) const | core::scoring::geometric_solvation::ExactOccludedHbondSolEnergy | |
compute_polar_group_sol_energy(pose::Pose const &pose, conformation::Residue const &polar_rsd, Size const polar_atom, bool const restrict_to_single_occluding_residue=false, Size const single_occluding_resinx=0, bool const restrict_to_single_occluding_atom=false, Size const single_occluding_atominx=0) const | core::scoring::geometric_solvation::ExactOccludedHbondSolEnergy | |
compute_polar_group_sol_energy(pose::Pose const &pose, conformation::Residue const &polar_rsd, core::Size const polar_atomno, GridInfo const &grid_info, core::Real const &grid_constant, std::vector< std::vector< std::vector< core::Real > > > const &water_weights, bool const restrict_to_single_occluding_residue=false, core::Size const single_occluding_resinx=0, bool const restrict_to_single_occluding_atom=false, core::Size const single_occluding_atominx=0) const | core::scoring::geometric_solvation::ExactOccludedHbondSolEnergy | |
ContextDependentOneBodyEnergy(EnergyMethodCreatorOP) | core::scoring::methods::ContextDependentOneBodyEnergy | |
defines_dof_derivatives(pose::Pose const &p) const | core::scoring::methods::OneBodyEnergy | virtual |
defines_high_order_terms(pose::Pose const &) const | core::scoring::methods::EnergyMethod | virtual |
defines_intrares_energy(EnergyMap const &) const | core::scoring::geometric_solvation::ExactOccludedHbondSolEnergy | inlinevirtual |
defines_score_for_residue(conformation::Residue const &) const | core::scoring::methods::OneBodyEnergy | virtual |
EnergyMethod(EnergyMethodCreatorOP creator) | core::scoring::methods::EnergyMethod | |
EnergyMethod(EnergyMethod const &src) | core::scoring::methods::EnergyMethod | |
eval_atom_derivative(id::AtomID const &id, pose::Pose const &pose, kinematics::DomainMap const &domain_map, ScoreFunction const &sfxn, EnergyMap const &emap, Vector &F1, Vector &F2) const | core::scoring::methods::EnergyMethod | virtual |
eval_residue_derivatives(conformation::Residue const &rsd, ResSingleMinimizationData const &min_data, pose::Pose const &pose, EnergyMap const &weights, utility::vector1< DerivVectorPair > &atom_derivs) const | core::scoring::methods::OneBodyEnergy | virtual |
eval_residue_dof_derivative(conformation::Residue const &rsd, ResSingleMinimizationData const &min_data, id::DOF_ID const &dof_id, id::TorsionID const &torsion_id, pose::Pose const &pose, ScoreFunction const &sfxn, EnergyMap const &weights) const | core::scoring::methods::OneBodyEnergy | virtual |
exact_occ_include_Hbond_contribution_ | core::scoring::geometric_solvation::ExactOccludedHbondSolEnergy | private |
exact_occ_pairwise_ | core::scoring::geometric_solvation::ExactOccludedHbondSolEnergy | private |
exact_occ_pairwise_by_res_ | core::scoring::geometric_solvation::ExactOccludedHbondSolEnergy | private |
exact_occ_self_res_occ_ | core::scoring::geometric_solvation::ExactOccludedHbondSolEnergy | private |
exact_occ_skip_Hbonders_ | core::scoring::geometric_solvation::ExactOccludedHbondSolEnergy | private |
exact_occ_split_between_res_ | core::scoring::geometric_solvation::ExactOccludedHbondSolEnergy | private |
ExactOccludedHbondSolEnergy(bool const exact_occ_skip_Hbonders=false, bool const exact_occ_include_Hbond_contribution=false, bool const exact_occ_pairwise=false, bool const exact_occ_pairwise_by_res=false, bool const exact_occ_split_between_res=false, bool const exact_occ_self_res_occ=true, core::Real const occ_radius_scaling=1., bool const verbose=false) | core::scoring::geometric_solvation::ExactOccludedHbondSolEnergy | |
ExactOccludedHbondSolEnergy(ExactOccludedHbondSolEnergy const &src) | core::scoring::geometric_solvation::ExactOccludedHbondSolEnergy | |
finalize_after_derivatives(pose::Pose &, ScoreFunction const &) const | core::scoring::methods::EnergyMethod | virtual |
finalize_total_energy(pose::Pose &pose, ScoreFunction const &sfxn, EnergyMap &total_energy) const | core::scoring::methods::EnergyMethod | virtual |
hb_database_ | core::scoring::geometric_solvation::ExactOccludedHbondSolEnergy | private |
hbondoptions_ | core::scoring::geometric_solvation::ExactOccludedHbondSolEnergy | private |
indicate_required_context_graphs(utility::vector1< bool > &) const | core::scoring::geometric_solvation::ExactOccludedHbondSolEnergy | inlinevirtual |
method_type() const | core::scoring::methods::ContextDependentOneBodyEnergy | virtual |
minimize_in_whole_structure_context(pose::Pose const &) const | core::scoring::methods::EnergyMethod | virtual |
occ_radius_scaling_ | core::scoring::geometric_solvation::ExactOccludedHbondSolEnergy | private |
occluded_sites_ | core::scoring::geometric_solvation::ExactOccludedHbondSolEnergy | mutableprivate |
OneBodyEnergy(EnergyMethodCreatorOP) | core::scoring::methods::OneBodyEnergy | |
parent typedef | core::scoring::methods::ContextDependentOneBodyEnergy | |
prepare_rotamers_for_packing(pose::Pose const &, conformation::RotamerSetBase &) const | core::scoring::methods::EnergyMethod | virtual |
requires_a_setup_for_derivatives_for_residue_opportunity(pose::Pose const &pose) const | core::scoring::methods::OneBodyEnergy | virtual |
requires_a_setup_for_scoring_for_residue_opportunity(pose::Pose const &pose) const | core::scoring::methods::OneBodyEnergy | virtual |
residue_energy(conformation::Residue const &polar_rsd, pose::Pose const &pose, EnergyMap &emap) const | core::scoring::geometric_solvation::ExactOccludedHbondSolEnergy | virtual |
residue_energy_ext(conformation::Residue const &rsd, ResSingleMinimizationData const &min_data, pose::Pose const &pose, EnergyMap &emap) const | core::scoring::methods::OneBodyEnergy | virtual |
score_types() const | core::scoring::methods::EnergyMethod | inline |
set_score_types(EnergyMethodCreatorOP creator) | core::scoring::methods::EnergyMethod | protected |
setup_for_derivatives(pose::Pose &pose, ScoreFunction const &) const | core::scoring::geometric_solvation::ExactOccludedHbondSolEnergy | virtual |
setup_for_derivatives_for_residue(conformation::Residue const &rsd, pose::Pose const &pose, ScoreFunction const &sfxn, ResSingleMinimizationData &min_data) const | core::scoring::methods::OneBodyEnergy | virtual |
setup_for_minimizing(pose::Pose &pose, ScoreFunction const &, kinematics::MinimizerMapBase const &) const | core::scoring::geometric_solvation::ExactOccludedHbondSolEnergy | virtual |
setup_for_minimizing_for_residue(conformation::Residue const &rsd, pose::Pose const &, ScoreFunction const &, kinematics::MinimizerMapBase const &, ResSingleMinimizationData &) const | core::scoring::methods::OneBodyEnergy | virtual |
setup_for_packing(pose::Pose &pose, utility::vector1< bool > const &, utility::vector1< bool > const &) const | core::scoring::geometric_solvation::ExactOccludedHbondSolEnergy | virtual |
setup_for_scoring(pose::Pose &pose, ScoreFunction const &) const | core::scoring::geometric_solvation::ExactOccludedHbondSolEnergy | virtual |
setup_for_scoring_for_residue(conformation::Residue const &rsd, pose::Pose const &pose, ScoreFunction const &sfxn, ResSingleMinimizationData &min_data) const | core::scoring::methods::OneBodyEnergy | virtual |
update_residue_for_packing(pose::Pose &, Size resid) const | core::scoring::methods::EnergyMethod | virtual |
use_extended_residue_energy_interface() const | core::scoring::methods::OneBodyEnergy | virtual |
verbose_ | core::scoring::geometric_solvation::ExactOccludedHbondSolEnergy | private |
version() const | core::scoring::geometric_solvation::ExactOccludedHbondSolEnergy | privatevirtual |
~EnergyMethod() | core::scoring::methods::EnergyMethod | virtual |
~ExactOccludedHbondSolEnergy() | core::scoring::geometric_solvation::ExactOccludedHbondSolEnergy | |
~OneBodyEnergy() | core::scoring::methods::OneBodyEnergy | virtual |