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core::pack::interaction_graph::HPatchInteractionGraph< V, E, G > Member List

This is the complete list of members for core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >, including all inherited members.

add_background_edge(int first_class_node_index, int bg_node_index)core::pack::interaction_graph::AdditionalBackgroundNodesInteractionGraph< V, E, G >protected
AdditionalBackgroundNodesInteractionGraph(int num_nodes)core::pack::interaction_graph::AdditionalBackgroundNodesInteractionGraph< V, E, G >
alt_bg_bg_exhpobeolap_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
alt_state_being_considered_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
BackgroundEdgeList typedefcore::pack::interaction_graph::AdditionalBackgroundNodesInteractionGraph< V, E, G >
BackgroundEdgeListConstIter typedefcore::pack::interaction_graph::AdditionalBackgroundNodesInteractionGraph< V, E, G >
BackgroundEdgeListIter typedefcore::pack::interaction_graph::AdditionalBackgroundNodesInteractionGraph< V, E, G >
BackgroundNodeVector typedefcore::pack::interaction_graph::AdditionalBackgroundNodesInteractionGraph< V, E, G >
bg_bg_atom_atom_overlaps_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
bg_bg_respairs_w_hphobe_olap_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
bg_exp_hphobe_djs_offsets_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
bg_n_exp_hphobes_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
bg_node_2_resid(Size node_index)core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
bg_nodes_near_rotsub_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
bg_nodes_near_rotsub_bool_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
bgenumeration_2_resid_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
blanket_assign_state_0() overridecore::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
calculate_alt_state_hpatch_score()core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
calculate_hpatch_deltaE()core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
calculated_hpatch_deltaE_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
carbon_atomcore::pack::interaction_graph::HPatchInteractionGraph< V, E, G >privatestatic
clean_up_bgtfc_edges_marked_for_deletion()core::pack::interaction_graph::AdditionalBackgroundNodesInteractionGraph< V, E, G >protected
commit_considered_substitution() overridecore::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
COMMIT_LIMIT_BETWEEN_UPDATEScore::pack::interaction_graph::HPatchInteractionGraph< V, E, G >privatestatic
consider_substitution(int node_ind, int new_state, core::PackerEnergy &delta_energy, core::PackerEnergy &prev_energy_for_node) overridecore::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
count_dynamic_memory() const overridecore::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
count_static_memory() const overridecore::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
create_background_edge(int fc_node_index, int bg_node_index) overridecore::pack::interaction_graph::HPatchInteractionGraph< V, E, G >protectedvirtual
create_background_node(int node_index) overridecore::pack::interaction_graph::HPatchInteractionGraph< V, E, G >protectedvirtual
create_new_edge(int index1, int index2) overridecore::pack::interaction_graph::HPatchInteractionGraph< V, E, G >protected
create_new_node(int node_index, int num_states) overridecore::pack::interaction_graph::HPatchInteractionGraph< V, E, G >protected
curr_bg_bg_exhpobeolap_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
decide_procrastinate_hpatch_computations(Real const pd_deltaE, Real const threshold) const core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
deltaE_for_substitution_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
deltaE_threshold_for_avoiding_hpatch_calcs_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
detect_background_residue_and_first_class_residue_overlap()core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
djs_id_2_hphobe_index_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
djs_rep_node_index_2_cc_index_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
drop_background_edge(BackgroundEdgeListIter iter)core::pack::interaction_graph::AdditionalBackgroundNodesInteractionGraph< V, E, G >protected
ep_sasa_for_djs_node_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
fc_exp_hphobe_djs_offsets_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
fc_n_exp_hphobes_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
fc_nodes_near_rotsub_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
fc_nodes_near_rotsub_bool_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
find_background_edge(int first_class_node_index, int bg_node_index) const core::pack::interaction_graph::AdditionalBackgroundNodesInteractionGraph< V, E, G >protected
get_all_sasas(utility::vector1< Real > &node_sasas, utility::vector1< Real > &bgnode_sasas)core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
get_background_node(int index) const core::pack::interaction_graph::AdditionalBackgroundNodesInteractionGraph< V, E, G >inlineprotected
get_bg_bg_atom_atom_overlaps(Size node1_index, Size node2_index)core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
get_bg_edge_list_begin() const core::pack::interaction_graph::AdditionalBackgroundNodesInteractionGraph< V, E, G >inlineprotected
get_bg_edge_list_end() const core::pack::interaction_graph::AdditionalBackgroundNodesInteractionGraph< V, E, G >inlineprotected
get_edge_memory_usage() const overridecore::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
get_energy_current_state_assignment() overridecore::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
get_energy_sum_for_vertex_group(Size group_id)core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >virtual
get_hpatch_bg_node(int index) const core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >inline
get_hpatch_node(int index) const core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >inline
get_hpatch_score()core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
get_network_state() const core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
get_num_background_nodes() const core::pack::interaction_graph::AdditionalBackgroundNodesInteractionGraph< V, E, G >inline
get_num_bg_edges() const core::pack::interaction_graph::AdditionalBackgroundNodesInteractionGraph< V, E, G >inlineprotected
getTotalMemoryUsage() const overridecore::pack::interaction_graph::AdditionalBackgroundNodesInteractionGraph< V, E, G >
hpatch_energy_alternate_state_assignment_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
hpatch_energy_current_state_assignment_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
hpatch_score_min_last_100_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
hpatch_score_min_recent_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
hpatch_score_weight_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
HPatchInteractionGraph(int num_nodes)core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
HPatchInteractionGraph()core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
HPatchInteractionGraph(HPatchInteractionGraph< V, E, G > const &)core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
init_SASA_radii_from_database()core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
initialize(pack_basic::RotamerSetsBase const &rot_sets) overridecore::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
initialize_bg_bg_atom_atom_overlaps()core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
initialize_bg_bg_overlaps()core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
initialized_SASA_radiicore::pack::interaction_graph::HPatchInteractionGraph< V, E, G >privatestatic
node_considering_alt_state_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
num_commits_since_last_update_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
num_hpatch_comps_later_made_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >privatestatic
num_hpatch_comps_procrastinated_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >privatestatic
num_residues_assigned_as_background_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
num_state_substitutions_considered_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >privatestatic
num_substitutions_since_hpatch_min_update_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
num_total_residues_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
observed_sufficient_hpatch_E_to_predict_min_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
operator=(HPatchInteractionGraph< V, E, G > const &)core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
packer_task() const core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >inline
packer_task_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
parent typedefcore::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
pose() const core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >inline
pose_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
prepare_graph_for_simulated_annealing() overridecore::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
prepared_for_simulated_annealing_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
print() const overridecore::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
print_hpatch_avoidance_stats()core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >static
print_internal_energies_for_current_state_assignment()core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
radii_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >privatestatic
register_bg_node_affected_by_rotsub(int bg_node_ind)core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
register_fc_node_affected_by_rotsub(int fc_node_ind)core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
register_fc_node_in_state0()core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
reps_for_nonzero_rank_ccs_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
reset_from_previous_deltaHpatch_comp()core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
reset_hpatch_avoidance_stats()core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >static
resid_2_bgenumeration_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
rotamer_sets() const core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >inline
rotamer_sets_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
sasa_for_cc_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
set_background_residue_rotamer_dots(Size residue, conformation::Residue const &rotamer)core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
set_errorfull_deltaE_threshold(core::PackerEnergy deltaE) overridecore::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
set_network_state(ObjexxFCL::FArray1_int &node_states) overridecore::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
set_num_background_nodes(int num_bg_nodes)core::pack::interaction_graph::AdditionalBackgroundNodesInteractionGraph< V, E, G >protected
set_num_background_residues(Size num_background_residues)core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
set_num_residues_in_protein(Size num_res)core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
set_observed_sufficient_boolean_true()core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
set_packer_task(task::PackerTask const &task)core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
set_pose(pose::Pose const &pose)core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
set_residue_as_background_residue(int residue)core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
set_rotamer_dots_for_node_state(Size node_index, Size state, conformation::Residue const &rotamer)core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
set_rotamer_sets(rotamer_set::RotamerSets const &rotsets)core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
set_score_weight(Real weight)core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >inline
some_node_in_state_0_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
sulfur_atomcore::pack::interaction_graph::HPatchInteractionGraph< V, E, G >privatestatic
total_energy_alternate_state_assignment_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
total_energy_current_state_assignment_core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >private
track_hpatch_E_min()core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >protected
update_disjoint_sets_using_cache(conformation::Residue const &rsd, InvRotamerDots const &invdots, utility::vector1< Size > const &exp_hphobes, Size residue_djs_offset, utility::vector1< utility::vector1< bool > > const &atom_atom_self_overlap, utility::graph::DisjointSets &ds)core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
update_disjoint_sets_using_cache(conformation::Residue const &rsd1, InvRotamerDots const &invdots1, utility::vector1< Size > const &exp_hphobes1, Size djs_offset_1, conformation::Residue const &rsd2, InvRotamerDots const &invdots2, utility::vector1< Size > const &exp_hphobes2, Size djs_offset_2, utility::vector1< utility::vector1< bool > > const &atom_atom_overlaps, utility::graph::DisjointSets &ds)core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >
update_internal_energy_totals_hpatch()core::pack::interaction_graph::HPatchInteractionGraph< V, E, G >protected
~AdditionalBackgroundNodesInteractionGraph() overridecore::pack::interaction_graph::AdditionalBackgroundNodesInteractionGraph< V, E, G >
~HPatchInteractionGraph() overridecore::pack::interaction_graph::HPatchInteractionGraph< V, E, G >