aa(AA const &type) | core::chemical::ResidueTypeBase | inline |
aa(std::string const &type) | core::chemical::ResidueTypeBase | inline |
aa() const | core::chemical::ResidueTypeBase | inline |
abase2(Size const atomno) const | core::chemical::ResidueType | |
abase2_indices_ | core::chemical::ResidueType | private |
accpt_pos() const | core::chemical::ResidueType | inline |
accpt_pos_ | core::chemical::ResidueType | private |
accpt_pos_sc() const | core::chemical::ResidueType | inline |
accpt_pos_sc_ | core::chemical::ResidueType | private |
actcoord_atoms() const | core::chemical::ResidueType | inline |
actcoord_atoms_indices_ | core::chemical::ResidueType | private |
add_adduct(Adduct &adduct_in) | core::chemical::ResidueTypeBase | inline |
add_numeric_property(std::string const &tag, core::Real value) | core::chemical::ResidueTypeBase | |
add_property(std::string const &property) | core::chemical::ResidueTypeBase | |
add_property(core::chemical::ResidueProperty const property) | core::chemical::ResidueTypeBase | |
add_string_property(std::string const &tag, std::string value) | core::chemical::ResidueTypeBase | |
add_variant_type(VariantType const variant_type) | core::chemical::ResidueTypeBase | |
add_variant_type(std::string const &variant_type) | core::chemical::ResidueTypeBase | |
all_bb_atoms() const | core::chemical::ResidueType | inline |
all_bb_atoms_ | core::chemical::ResidueType | private |
all_sc_atoms() const | core::chemical::ResidueType | inline |
all_sc_atoms_ | core::chemical::ResidueType | private |
atom_2_residue_connection_map_ | core::chemical::ResidueType | private |
atom_alias(std::string const &name) const | core::chemical::ResidueTypeBase | inline |
atom_aliases() const | core::chemical::ResidueTypeBase | inline |
atom_aliases() | core::chemical::ResidueTypeBase | inlineprotected |
atom_base(Size const atomno) const | core::chemical::ResidueType | |
atom_base_indices_ | core::chemical::ResidueType | private |
atom_being_shadowed(Size atom_shadowing) const | core::chemical::ResidueType | inline |
atom_charge(Size const atomno) const | core::chemical::ResidueType | inline |
atom_depends_on_connection(core::Size const atom_index, core::Size const connection_id) const | core::chemical::ResidueType | |
atom_depends_on_connection_ | core::chemical::ResidueType | private |
atom_depends_on_lower_polymeric_connection(core::Size const atom_index) const | core::chemical::ResidueType | |
atom_depends_on_lower_polymeric_connection_ | core::chemical::ResidueType | private |
atom_depends_on_polymeric_connection(core::Size const atom_index) const | core::chemical::ResidueType | |
atom_depends_on_upper_polymeric_connection(core::Size const atom_index) const | core::chemical::ResidueType | |
atom_depends_on_upper_polymeric_connection_ | core::chemical::ResidueType | private |
atom_forms_residue_connection(Size const atomid) const | core::chemical::ResidueType | inline |
atom_has_property(Size const atomno, AtomProperty const property) const | core::chemical::ResidueType | |
atom_index(std::string const &atom_name) const | core::chemical::ResidueType | inline |
atom_is_aro_hydrogen(Size atomno) const | core::chemical::ResidueType | inline |
atom_is_backbone(Size const atomno) const | core::chemical::ResidueType | inline |
atom_is_hydrogen(Size const atomno) const | core::chemical::ResidueType | inline |
atom_is_polar_hydrogen(Size atomno) const | core::chemical::ResidueType | inline |
atom_is_sidechain(Size const atomno) const | core::chemical::ResidueType | inline |
atom_name(Size const atomno) const | core::chemical::ResidueType | inline |
atom_name_to_index_ | core::chemical::ResidueType | private |
atom_names_ | core::chemical::ResidueType | private |
atom_properties(Size const atomno) const | core::chemical::ResidueType | inline |
atom_shadowed_indices_ | core::chemical::ResidueType | private |
atom_type(Size const atomno) const | core::chemical::ResidueType | inline |
atom_type_index(core::Size atomno) const | core::chemical::ResidueType | inline |
atom_type_set() const | core::chemical::ResidueTypeBase | inline |
atom_type_set(AtomTypeSetCOP setting) | core::chemical::ResidueTypeBase | protected |
atom_type_set_ptr() const | core::chemical::ResidueTypeBase | inline |
atomic_properties_ | core::chemical::ResidueType | private |
atoms_are_bonded(core::Size const atomindex1, core::Size const atomindex2) const | core::chemical::ResidueType | |
atoms_last_controlled_by_chi() const | core::chemical::ResidueType | inline |
atoms_last_controlled_by_chi(Size chi) const | core::chemical::ResidueType | inline |
atoms_last_controlled_by_chi_ | core::chemical::ResidueType | private |
atoms_with_orb_index() const | core::chemical::ResidueType | inline |
atoms_with_orb_index_ | core::chemical::ResidueType | private |
atoms_within_one_bond_of_a_residue_connection(Size resconn) const | core::chemical::ResidueType | inline |
atoms_within_one_bond_of_a_residue_connection_ | core::chemical::ResidueType | private |
atoms_within_two_bonds_of_a_residue_connection(Size resconn) const | core::chemical::ResidueType | inline |
atoms_within_two_bonds_of_a_residue_connection_ | core::chemical::ResidueType | private |
attach_destruction_obs(MemFn fn, Ptr ptr) const | core::chemical::ResidueType | inline |
attached_H_begin() const | core::chemical::ResidueType | inline |
attached_H_begin(Size const atom) const | core::chemical::ResidueType | inline |
attached_H_begin_ | core::chemical::ResidueType | private |
attached_H_end() const | core::chemical::ResidueType | inline |
attached_H_end(Size const atom) const | core::chemical::ResidueType | inline |
attached_H_end_ | core::chemical::ResidueType | private |
auto_assign_nu_atoms() | core::chemical::ResidueType | private |
backbone_aa(std::string const &type) | core::chemical::ResidueTypeBase | inline |
backbone_aa() const | core::chemical::ResidueTypeBase | inline |
backbone_aa_raw() const | core::chemical::ResidueTypeBase | inlineprotected |
base_analogue(std::string const &type) | core::chemical::ResidueTypeBase | inline |
base_analogue() const | core::chemical::ResidueTypeBase | inline |
base_analogue_raw() const | core::chemical::ResidueTypeBase | inlineprotected |
base_name() const | core::chemical::ResidueTypeBase | inline |
base_name(std::string const &base_name_in) | core::chemical::ResidueTypeBase | inline |
base_type_cop_ | core::chemical::ResidueType | private |
bond_ringness(core::Size const atomindex1, core::Size const atomindex2) const | core::chemical::ResidueType | |
bond_type(core::Size const atomindex1, core::Size const atomindex2) const | core::chemical::ResidueType | |
bondangle(Size const bondang) const | core::chemical::ResidueType | inline |
bondangle_atom_sets_ | core::chemical::ResidueType | private |
bondangles_for_atom(Size atomno) const | core::chemical::ResidueType | inline |
bondangles_for_atom_ | core::chemical::ResidueType | private |
bonded_neighbor(Size const atomno) const | core::chemical::ResidueType | |
bonded_neighbor_ | core::chemical::ResidueType | private |
bonded_neighbor_ringness_ | core::chemical::ResidueType | private |
bonded_neighbor_ringnesses(Size const atomno) const | core::chemical::ResidueType | |
bonded_neighbor_type_ | core::chemical::ResidueType | private |
bonded_neighbor_types(Size const atomno) const | core::chemical::ResidueType | |
bonded_orbitals(Size const atomno) const | core::chemical::ResidueType | inline |
bonded_orbitals_ | core::chemical::ResidueType | private |
bonds() const | core::chemical::ResidueType | |
branch_connect_atom_names() const | core::chemical::ResidueType | |
branch_connect_atoms() const | core::chemical::ResidueType | |
canonical_atom_alias(std::string const &name) const | core::chemical::ResidueTypeBase | inline |
canonical_atom_aliases() const | core::chemical::ResidueTypeBase | inline |
canonical_atom_aliases() | core::chemical::ResidueTypeBase | inlineprotected |
carbohydrate_info() const | core::chemical::ResidueType | |
carbohydrate_info_ | core::chemical::ResidueType | private |
chi_2_proton_chi(Size chi_index) const | core::chemical::ResidueType | inline |
chi_2_proton_chi_ | core::chemical::ResidueType | private |
chi_atoms(Size const chino) const | core::chemical::ResidueType | inline |
chi_atoms() const | core::chemical::ResidueType | inline |
chi_atoms_ | core::chemical::ResidueType | private |
chi_rotamers(Size const chino) const | core::chemical::ResidueType | inline |
chi_rotamers_ | core::chemical::ResidueType | private |
clone() const =delete | core::chemical::ResidueType | private |
copy_atom_info(MutableResidueType const &source, utility::vector1< core::Size > const &old_to_new) | core::chemical::ResidueType | private |
copy_other_info(MutableResidueType const &source, utility::vector1< core::Size > const &old_to_new) | core::chemical::ResidueType | private |
custom_variant_types() const | core::chemical::ResidueTypeBase | |
cut_bond_neighbor(Size const atomno) const | core::chemical::ResidueType | inline |
cut_bond_neighbor_indices_ | core::chemical::ResidueType | private |
debug_dump_icoor() const | core::chemical::ResidueType | |
define_mainchain_atoms() | core::chemical::ResidueType | private |
defined_adducts() const | core::chemical::ResidueTypeBase | inline |
defines_custom_rama_prepro_map(bool const pre_proline_position) const | core::chemical::ResidueTypeBase | |
delete_property(std::string const &property) | core::chemical::ResidueTypeBase | |
delete_property(core::chemical::ResidueProperty const property) | core::chemical::ResidueTypeBase | |
destruction_obs_hub_ | core::chemical::ResidueType | mutableprivate |
detach_destruction_obs(MemFn fn, Ptr ptr) const | core::chemical::ResidueType | inline |
dihedral(Size const dihe) const | core::chemical::ResidueType | inline |
dihedral_atom_sets_ | core::chemical::ResidueType | private |
dihedrals_for_atom(Size atomno) const | core::chemical::ResidueType | inline |
dihedrals_for_atom_ | core::chemical::ResidueType | private |
element(core::Size atomno) const | core::chemical::ResidueType | |
element_set() const | core::chemical::ResidueTypeBase | inline |
element_set_ptr() const | core::chemical::ResidueTypeBase | inline |
element_type(core::Size atomno) const | core::chemical::ResidueType | inline |
elements_ | core::chemical::ResidueType | private |
enable_custom_variant_types() | core::chemical::ResidueTypeBase | |
first_sidechain_atom() const | core::chemical::ResidueType | inline |
first_sidechain_hydrogen() const | core::chemical::ResidueType | inline |
first_sidechain_hydrogen_ | core::chemical::ResidueType | private |
force_nbr_atom_orient() const | core::chemical::ResidueTypeBase | inline |
force_nbr_atom_orient(bool force_orient) | core::chemical::ResidueTypeBase | inline |
formal_charge(Size const atomno) const | core::chemical::ResidueType | inline |
formal_charge_ | core::chemical::ResidueType | private |
gasteiger_atom_type(core::Size atomno) const | core::chemical::ResidueType | |
gasteiger_atom_type_index_ | core::chemical::ResidueType | private |
gasteiger_atom_typeset() const | core::chemical::ResidueTypeBase | |
get_base_type_cop() const override | core::chemical::ResidueType | virtual |
get_disulfide_atom_name() const | core::chemical::ResidueTypeBase | inline |
get_metal_binding_atoms(AtomIndices &metal_binding_indices) const | core::chemical::ResidueType | inline |
core::chemical::ResidueTypeBase::get_metal_binding_atoms() const | core::chemical::ResidueTypeBase | inline |
get_numeric_property(std::string const &tag) const | core::chemical::ResidueTypeBase | |
get_orbitals() | core::chemical::ResidueTypeBase | inlineprotected |
get_orbitals_index() | core::chemical::ResidueTypeBase | inlineprotected |
get_rama_prepro_mainchain_torsion_potential_name(bool const pre_proline_position) const | core::chemical::ResidueTypeBase | |
get_rama_prepro_map_file_name(bool const pre_proline_position) const | core::chemical::ResidueTypeBase | |
get_self_ptr() const | core::chemical::ResidueType | inline |
get_self_ptr() | core::chemical::ResidueType | inline |
get_self_weak_ptr() const | core::chemical::ResidueType | inline |
get_self_weak_ptr() | core::chemical::ResidueType | inline |
get_string_property(std::string const &tag) const | core::chemical::ResidueTypeBase | |
Haro_index() const | core::chemical::ResidueType | inline |
Haro_index_ | core::chemical::ResidueType | private |
has(std::string const &atom_name) const override | core::chemical::ResidueType | inlinevirtual |
has_orbital(std::string const &orbital_name) const | core::chemical::ResidueTypeBase | inline |
has_orbital_types() const | core::chemical::ResidueTypeBase | inline |
has_polymer_dependent_groups() const | core::chemical::ResidueType | inline |
has_polymer_dependent_groups_ | core::chemical::ResidueType | private |
has_property(std::string const &property) const | core::chemical::ResidueTypeBase | |
has_property(ResidueProperty const property) const | core::chemical::ResidueTypeBase | |
has_sc_orbitals() const | core::chemical::ResidueType | |
has_shadow_atoms() const | core::chemical::ResidueType | inline |
has_variant_type(VariantType const variant_type) const | core::chemical::ResidueTypeBase | |
has_variant_type(std::string const &variant_type) const | core::chemical::ResidueTypeBase | |
heavyatom_has_polar_hydrogens(Size atomno) const | core::chemical::ResidueType | |
heavyatom_has_polar_hydrogens_ | core::chemical::ResidueType | private |
heavyatom_is_an_acceptor(Size atomno) const | core::chemical::ResidueType | inline |
Hpol_index() const | core::chemical::ResidueType | inline |
Hpol_index_ | core::chemical::ResidueType | private |
Hpos_apolar() const | core::chemical::ResidueType | inline |
Hpos_apolar_ | core::chemical::ResidueType | private |
Hpos_polar() const | core::chemical::ResidueType | inline |
Hpos_polar_ | core::chemical::ResidueType | private |
Hpos_polar_sc() const | core::chemical::ResidueType | inline |
Hpos_polar_sc_ | core::chemical::ResidueType | private |
icoor(Size const atm) const | core::chemical::ResidueType | |
icoor_ | core::chemical::ResidueType | private |
ideal_xyz(Size const atomno) const | core::chemical::ResidueType | inline |
ideal_xyz(std::string const &atomname) const | core::chemical::ResidueType | inline |
ideal_xyz_ | core::chemical::ResidueType | private |
initialize_derived_data() | core::chemical::ResidueType | private |
interchangeability_group() const | core::chemical::ResidueTypeBase | inline |
interchangeability_group(std::string setting) | core::chemical::ResidueTypeBase | inline |
is_acetylated_nterminus() const | core::chemical::ResidueType | |
is_achiral_backbone() const | core::chemical::ResidueTypeBase | inline |
is_achiral_sidechain() const | core::chemical::ResidueTypeBase | inline |
is_adduct() const | core::chemical::ResidueType | |
is_alpha_aa() const | core::chemical::ResidueType | inline |
is_aramid() const | core::chemical::ResidueType | inline |
is_aromatic() const | core::chemical::ResidueType | |
is_base_type() const override | core::chemical::ResidueType | virtual |
is_beta_aa() const | core::chemical::ResidueType | inline |
is_branch_point() const | core::chemical::ResidueType | |
is_canonical() const | core::chemical::ResidueType | |
is_canonical_aa() const | core::chemical::ResidueType | |
is_canonical_nucleic() const | core::chemical::ResidueType | |
is_carbohydrate() const | core::chemical::ResidueType | |
is_charged() const | core::chemical::ResidueType | |
is_coarse() const | core::chemical::ResidueType | |
is_cyclic() const | core::chemical::ResidueType | |
is_d_aa() const | core::chemical::ResidueTypeBase | inline |
is_d_rna() const | core::chemical::ResidueTypeBase | inline |
is_disulfide_bonded() const | core::chemical::ResidueType | inline |
is_DNA() const | core::chemical::ResidueTypeBase | inline |
is_gamma_aa() const | core::chemical::ResidueType | inline |
is_inverted_virtual_residue() const | core::chemical::ResidueType | |
is_l_aa() const | core::chemical::ResidueTypeBase | inline |
is_l_rna() const | core::chemical::ResidueTypeBase | inline |
is_ligand() const | core::chemical::ResidueType | |
is_lipid() const | core::chemical::ResidueType | |
is_lower_terminus() const | core::chemical::ResidueType | |
is_membrane() const | core::chemical::ResidueType | |
is_meta_aramid() const | core::chemical::ResidueType | inline |
is_metal() const | core::chemical::ResidueType | |
is_metalbinding() const | core::chemical::ResidueType | |
is_metapatched() const | core::chemical::ResidueTypeBase | inline |
is_methylated_cterminus() const | core::chemical::ResidueType | |
is_mirrored_type() const | core::chemical::ResidueType | inline |
is_n_methylated() const | core::chemical::ResidueType | inline |
is_NA() const | core::chemical::ResidueType | inline |
is_oligourea() const | core::chemical::ResidueType | inline |
is_ortho_aramid() const | core::chemical::ResidueType | inline |
is_para_aramid() const | core::chemical::ResidueType | inline |
is_peptoid() const | core::chemical::ResidueTypeBase | inline |
is_PNA() const | core::chemical::ResidueType | inline |
is_polar() const | core::chemical::ResidueType | |
is_polymer() const | core::chemical::ResidueTypeBase | inline |
is_post_methylene_meta_aramid() const | core::chemical::ResidueType | inline |
is_post_methylene_ortho_aramid() const | core::chemical::ResidueType | inline |
is_post_methylene_para_aramid() const | core::chemical::ResidueType | inline |
is_pre_methylene_meta_aramid() const | core::chemical::ResidueType | inline |
is_pre_methylene_ortho_aramid() const | core::chemical::ResidueType | inline |
is_pre_methylene_para_aramid() const | core::chemical::ResidueType | inline |
is_pre_methylene_post_methylene_meta_aramid() const | core::chemical::ResidueType | inline |
is_pre_methylene_post_methylene_ortho_aramid() const | core::chemical::ResidueType | inline |
is_pre_methylene_post_methylene_para_aramid() const | core::chemical::ResidueType | inline |
is_protein() const | core::chemical::ResidueTypeBase | inline |
is_proton_chi(Size const chino) const | core::chemical::ResidueType | inline |
is_proton_chi_ | core::chemical::ResidueType | private |
is_purine() const | core::chemical::ResidueType | |
is_pyrimidine() const | core::chemical::ResidueType | |
is_r_peptoid() const | core::chemical::ResidueTypeBase | inline |
is_repulsive(Size const atomno) const | core::chemical::ResidueType | |
is_ring_atom(uint const ring_num, uint const atom_id) const | core::chemical::ResidueType | |
is_RNA() const | core::chemical::ResidueTypeBase | inline |
is_s_peptoid() const | core::chemical::ResidueTypeBase | inline |
is_sidechain_amine() const | core::chemical::ResidueType | inline |
is_sidechain_thiol() const | core::chemical::ResidueType | inline |
is_solvent() const | core::chemical::ResidueType | |
is_sri() const | core::chemical::ResidueType | |
is_surface() const | core::chemical::ResidueType | |
is_terminus() const | core::chemical::ResidueType | inline |
is_TNA() const | core::chemical::ResidueType | inline |
is_TP3() const | core::chemical::ResidueType | |
is_triazolemer() const | core::chemical::ResidueType | |
is_upper_terminus() const | core::chemical::ResidueType | |
is_virtual(Size const atomno) const | core::chemical::ResidueType | |
is_virtual_residue() const | core::chemical::ResidueType | |
is_virtualizable_by_packer() const | core::chemical::ResidueType | inline |
is_VRT1() const | core::chemical::ResidueType | |
is_water() const | core::chemical::ResidueType | inline |
last_backbone_atom() const | core::chemical::ResidueType | inline |
last_controlling_chi() const | core::chemical::ResidueType | inline |
last_controlling_chi(Size atomno) const | core::chemical::ResidueType | inline |
last_controlling_chi_ | core::chemical::ResidueType | private |
low_ring_conformers() const | core::chemical::ResidueType | inline |
low_ring_conformers_ | core::chemical::ResidueType | private |
lower_connect() const | core::chemical::ResidueType | |
lower_connect_atom() const | core::chemical::ResidueType | |
lower_connect_id() const | core::chemical::ResidueType | inline |
lower_connect_id_ | core::chemical::ResidueType | private |
lowest_ring_conformer_ | core::chemical::ResidueType | private |
lowest_ring_conformers() const | core::chemical::ResidueType | inline |
mainchain_atom(Size const mainchain_index) const | core::chemical::ResidueType | inline |
mainchain_atoms() const | core::chemical::ResidueType | inline |
mainchain_atoms_indices_ | core::chemical::ResidueType | private |
mainchain_potentials_match(ResidueTypeBase const &other) const | core::chemical::ResidueTypeBase | |
make(MutableResidueType const &residue_type) | core::chemical::ResidueType | static |
mass() const | core::chemical::ResidueType | inline |
mass_ | core::chemical::ResidueType | private |
metal_binding_atoms() | core::chemical::ResidueTypeBase | inlineprotected |
mm_atom_type(Size const atomno) const | core::chemical::ResidueType | |
mm_atom_type_index(core::Size atomno) const | core::chemical::ResidueType | inline |
mm_atom_type_index_ | core::chemical::ResidueType | private |
mm_atom_types_ptr() const | core::chemical::ResidueTypeBase | inline |
mm_name(core::Size atomno) const | core::chemical::ResidueType | |
mode() const | core::chemical::ResidueTypeBase | inline |
n_backbone_heavyatoms_ | core::chemical::ResidueType | private |
n_hbond_acceptors() const | core::chemical::ResidueType | inline |
n_hbond_acceptors_ | core::chemical::ResidueType | private |
n_hbond_donors() const | core::chemical::ResidueType | inline |
n_hbond_donors_ | core::chemical::ResidueType | private |
n_non_polymeric_residue_connections() const | core::chemical::ResidueType | inline |
n_non_polymeric_residue_connections_ | core::chemical::ResidueType | private |
n_nus() const | core::chemical::ResidueType | inline |
n_orbitals() const | core::chemical::ResidueTypeBase | |
n_polymeric_residue_connections() const | core::chemical::ResidueType | inline |
n_polymeric_residue_connections_ | core::chemical::ResidueType | private |
n_possible_residue_connections() const | core::chemical::ResidueType | |
n_proton_chi() const | core::chemical::ResidueType | inline |
n_residue_connections_for_atom(Size const atomid) const | core::chemical::ResidueType | inline |
n_ring_conformer_sets() const | core::chemical::ResidueType | |
n_rings() const | core::chemical::ResidueType | inline |
n_virtual_atoms() const override | core::chemical::ResidueType | virtual |
na_analogue(std::string const &type) | core::chemical::ResidueTypeBase | inline |
na_analogue() const | core::chemical::ResidueTypeBase | inline |
na_analogue_raw() const | core::chemical::ResidueTypeBase | inlineprotected |
name() const | core::chemical::ResidueTypeBase | inline |
name(std::string const &name_in) | core::chemical::ResidueTypeBase | inline |
name1() const | core::chemical::ResidueTypeBase | inline |
name1(char const code) | core::chemical::ResidueTypeBase | inline |
name3() const | core::chemical::ResidueTypeBase | inline |
name3(std::string const &name_in) | core::chemical::ResidueTypeBase | inline |
natoms() const override | core::chemical::ResidueType | inlinevirtual |
natoms_ | core::chemical::ResidueType | private |
nbonds() const override | core::chemical::ResidueType | inlinevirtual |
nbonds(Size atom) const | core::chemical::ResidueType | inline |
nbonds_ | core::chemical::ResidueType | private |
nbr_atom() const | core::chemical::ResidueType | inline |
nbr_atom_ | core::chemical::ResidueType | private |
nbr_radius() const | core::chemical::ResidueType | inline |
nbr_radius_ | core::chemical::ResidueType | private |
nbrs(Size const atomno) const | core::chemical::ResidueType | inline |
nchi() const | core::chemical::ResidueType | inline |
ndihe() const | core::chemical::ResidueType | inline |
net_formal_charge() const | core::chemical::ResidueTypeBase | inline |
net_formal_charge(signed long int charge_in) | core::chemical::ResidueTypeBase | inline |
new_orbital_icoor_data(Size const orbital_index) const | core::chemical::ResidueType | |
nheavyatoms() const override | core::chemical::ResidueType | inlinevirtual |
nheavyatoms_ | core::chemical::ResidueType | private |
note_chi_controls_atom(Size chi, Size atomno) | core::chemical::ResidueType | private |
nu_atoms(core::uint const nu_index) const | core::chemical::ResidueType | inline |
nu_atoms() const | core::chemical::ResidueType | inline |
nu_atoms_ | core::chemical::ResidueType | private |
num_bondangles() const | core::chemical::ResidueType | inline |
number_bonded_heavyatoms(Size const atomno) const | core::chemical::ResidueType | |
number_bonded_hydrogens(Size const atomno) const | core::chemical::ResidueType | inline |
operator=(ResidueType const &src)=delete | core::chemical::ResidueType | private |
core::chemical::ResidueTypeBase::operator=(ResidueTypeBase const &)=default | core::chemical::ResidueTypeBase | protected |
orbital(Size const orbital_index) const | core::chemical::ResidueTypeBase | |
orbital(std::string const &orbital_name) const | core::chemical::ResidueTypeBase | |
orbital_icoor_data(Size const orbital_index) const | core::chemical::ResidueType | |
orbital_index(std::string const &name) const | core::chemical::ResidueTypeBase | |
orbital_type(Size const orbital_index) const | core::chemical::ResidueTypeBase | |
orbital_types_ptr() const | core::chemical::ResidueTypeBase | inline |
partial_charge_ | core::chemical::ResidueType | private |
path_distance(Size at1, Size at2) const | core::chemical::ResidueType | inline |
path_distance(Size atom) const | core::chemical::ResidueType | inline |
path_distance_ | core::chemical::ResidueType | private |
path_distances() const | core::chemical::ResidueType | inline |
perform_checks() const | core::chemical::ResidueType | private |
placeholder_clone() const =delete | core::chemical::ResidueType | private |
print_bondangles() const | core::chemical::ResidueType | |
print_pretty_path_distances() const | core::chemical::ResidueType | |
properties() const | core::chemical::ResidueTypeBase | inline |
proton_chi_2_chi(Size proton_chi_id) const | core::chemical::ResidueType | inline |
proton_chi_extra_samples(Size proton_chi) const | core::chemical::ResidueType | inline |
proton_chi_extra_samples_ | core::chemical::ResidueType | private |
proton_chi_samples(Size proton_chi) const | core::chemical::ResidueType | inline |
proton_chi_samples_ | core::chemical::ResidueType | private |
proton_chis_ | core::chemical::ResidueType | private |
remap_pdb_atom_names(bool rename) | core::chemical::ResidueTypeBase | inline |
remap_pdb_atom_names() const | core::chemical::ResidueTypeBase | inline |
remove_variant_type(VariantType const variant_type) | core::chemical::ResidueTypeBase | |
remove_variant_type(std::string const &variant_type) | core::chemical::ResidueTypeBase | |
report_adducts() const | core::chemical::ResidueTypeBase | |
requires_actcoord() const | core::chemical::ResidueType | |
reset_mainchain_torsion_potential_names() | core::chemical::ResidueTypeBase | |
residue_connect_atom_index(Size const resconn_id) const | core::chemical::ResidueType | |
residue_connection(Size const i) const | core::chemical::ResidueType | |
residue_connection_id_for_atom(Size const atomid) const | core::chemical::ResidueType | inline |
residue_connection_is_polymeric(Size const resconn_id) const | core::chemical::ResidueType | inline |
residue_connections_ | core::chemical::ResidueType | private |
residue_connections_for_atom(Size const atomid) const | core::chemical::ResidueType | inline |
ResidueType() | core::chemical::ResidueType | private |
ResidueType(MutableResidueType const &residue_type) | core::chemical::ResidueType | private |
ResidueType(ResidueType const &residue_type)=delete | core::chemical::ResidueType | private |
ResidueTypeBase() | core::chemical::ResidueTypeBase | protected |
ResidueTypeBase(AtomTypeSetCOP atom_types, ElementSetCOP element_types, MMAtomTypeSetCOP mm_atom_types, orbitals::OrbitalTypeSetCOP orbital_types) | core::chemical::ResidueTypeBase | protected |
ResidueTypeBase(ResidueTypeBase const &)=default | core::chemical::ResidueTypeBase | protected |
ring_atoms(uint const ring_num) const | core::chemical::ResidueType | inline |
ring_atoms() const | core::chemical::ResidueType | inline |
ring_atoms_ | core::chemical::ResidueType | private |
ring_conformer_set(core::uint ring_num) const | core::chemical::ResidueType | |
ring_conformer_sets_ | core::chemical::ResidueType | private |
ring_saturation_type(uint const ring_num) const | core::chemical::ResidueType | inline |
ring_saturation_types() const | core::chemical::ResidueType | inline |
ring_saturation_types_ | core::chemical::ResidueType | private |
RNA_info() const | core::chemical::ResidueType | |
rna_info_ | core::chemical::ResidueType | private |
root_atom() const | core::chemical::ResidueType | inline |
root_atom_ | core::chemical::ResidueType | private |
rotamer_library_specification(rotamers::RotamerLibrarySpecificationOP) | core::chemical::ResidueTypeBase | |
rotamer_library_specification() const | core::chemical::ResidueTypeBase | |
rotamer_library_specification_nonconst() | core::chemical::ResidueTypeBase | |
select_orient_atoms(Size ¢er, Size &nbr1, Size &nbr2) const | core::chemical::ResidueType | |
select_orient_atoms() const | core::chemical::ResidueType | |
select_orient_atoms_standard_logic(Size ¢er, Size &nbr1, Size &nbr2, bool const ignore_virtuals) const | core::chemical::ResidueType | |
self_pointer_updates() | core::chemical::ResidueType | private |
set_adduct_flag(bool adduct_in) | core::chemical::ResidueTypeBase | |
set_disulfide_atom_name(std::string const &n) | core::chemical::ResidueTypeBase | inline |
set_gasteiger_atom_typeset(gasteiger::GasteigerAtomTypeSetCOP setting) | core::chemical::ResidueTypeBase | |
set_metapatched() | core::chemical::ResidueTypeBase | inline |
set_orbital_typeset(orbitals::OrbitalTypeSetCOP setting) | core::chemical::ResidueTypeBase | inline |
set_properties(ResiduePropertiesOP properties) | core::chemical::ResidueTypeBase | |
set_rama_prepro_mainchain_torsion_potential_name(std::string const &name_in, bool const pre_proline_position) | core::chemical::ResidueTypeBase | |
set_rama_prepro_map_file_name(std::string const &filename_in, bool const pre_proline_position) | core::chemical::ResidueTypeBase | |
setup_atom_ordering(MutableResidueType const &source) | core::chemical::ResidueType | private |
show(std::ostream &output=std::cout, bool output_atomic_details=false) const override | core::chemical::ResidueType | virtual |
show_all_atom_names(std::ostream &out) const override | core::chemical::ResidueType | virtual |
strip_rotamer_library_specification() | core::chemical::ResidueTypeBase | |
update_derived_data() | core::chemical::ResidueType | private |
update_last_controlling_chi() | core::chemical::ResidueType | private |
update_ncaa_rotamer_library_specification_if_present() | core::chemical::ResidueType | private |
update_nonpolymer_dependent_groups() | core::chemical::ResidueType | private |
update_polymer_dependent_groups() | core::chemical::ResidueType | private |
update_ring_conformer_sets() | core::chemical::ResidueType | private |
upper_connect() const | core::chemical::ResidueType | |
upper_connect_atom() const | core::chemical::ResidueType | |
upper_connect_id() const | core::chemical::ResidueType | inline |
upper_connect_id_ | core::chemical::ResidueType | private |
variant_type_enums() const | core::chemical::ResidueTypeBase | |
variant_types() const | core::chemical::ResidueTypeBase | |
vec_atom_type_indexes_ | core::chemical::ResidueType | private |
vec_atom_types_ | core::chemical::ResidueType | private |
within1bonds_sets_for_atom(Size atomid) const | core::chemical::ResidueType | inline |
within1bonds_sets_for_atom_ | core::chemical::ResidueType | private |
within2bonds_sets_for_atom(Size atomid) const | core::chemical::ResidueType | inline |
within2bonds_sets_for_atom_ | core::chemical::ResidueType | private |
~ResidueType() override | core::chemical::ResidueType | |