Crate chemfiles_sys

Structs

• chfl_format_metadata
• chfl_match

Enums

• CHFL_ATOM
• CHFL_CELL
• CHFL_FRAME
• CHFL_PROPERTY
• CHFL_RESIDUE
• CHFL_SELECTION
• CHFL_TOPOLOGY
• CHFL_TRAJECTORY
• chfl_bond_order
• chfl_cellshape
• chfl_property_kind
• chfl_status

Functions

• chfl_add_configuration^⚠
• chfl_atom^⚠
• chfl_atom_atomic_number^⚠
• chfl_atom_charge^⚠
• chfl_atom_copy^⚠
• chfl_atom_covalent_radius^⚠
• chfl_atom_from_frame^⚠
• chfl_atom_from_topology^⚠
• chfl_atom_full_name^⚠
• chfl_atom_get_property^⚠
• chfl_atom_list_properties^⚠
• chfl_atom_mass^⚠
• chfl_atom_name^⚠
• chfl_atom_properties_count^⚠
• chfl_atom_set_charge^⚠
• chfl_atom_set_mass^⚠
• chfl_atom_set_name^⚠
• chfl_atom_set_property^⚠
• chfl_atom_set_type^⚠
• chfl_atom_type^⚠
• chfl_atom_vdw_radius^⚠
• chfl_cell^⚠
• chfl_cell_angles^⚠
• chfl_cell_copy^⚠
• chfl_cell_from_frame^⚠
• chfl_cell_from_matrix^⚠
• chfl_cell_lengths^⚠
• chfl_cell_matrix^⚠
• chfl_cell_set_angles^⚠
• chfl_cell_set_lengths^⚠
• chfl_cell_set_shape^⚠
• chfl_cell_shape^⚠
• chfl_cell_volume^⚠
• chfl_cell_wrap^⚠
• chfl_clear_errors^⚠
• chfl_formats_list^⚠
• chfl_frame^⚠
• chfl_frame_add_atom^⚠
• chfl_frame_add_bond^⚠
• chfl_frame_add_residue^⚠
• chfl_frame_add_velocities^⚠
• chfl_frame_angle^⚠
• chfl_frame_atoms_count^⚠
• chfl_frame_bond_with_order^⚠
• chfl_frame_clear_bonds^⚠
• chfl_frame_copy^⚠
• chfl_frame_dihedral^⚠
• chfl_frame_distance^⚠
• chfl_frame_get_property^⚠
• chfl_frame_guess_bonds^⚠
• chfl_frame_has_velocities^⚠
• chfl_frame_list_properties^⚠
• chfl_frame_out_of_plane^⚠
• chfl_frame_positions^⚠
• chfl_frame_properties_count^⚠
• chfl_frame_remove^⚠
• chfl_frame_remove_bond^⚠
• chfl_frame_resize^⚠
• chfl_frame_set_cell^⚠
• chfl_frame_set_property^⚠
• chfl_frame_set_step^⚠
• chfl_frame_set_topology^⚠
• chfl_frame_step^⚠
• chfl_frame_velocities^⚠
• chfl_free^⚠
• chfl_guess_format^⚠
• chfl_last_error^⚠
• chfl_property_bool^⚠
• chfl_property_double^⚠
• chfl_property_get_bool^⚠
• chfl_property_get_double^⚠
• chfl_property_get_kind^⚠
• chfl_property_get_string^⚠
• chfl_property_get_vector3d^⚠
• chfl_property_string^⚠
• chfl_property_vector3d^⚠
• chfl_residue^⚠
• chfl_residue_add_atom^⚠
• chfl_residue_atoms^⚠
• chfl_residue_atoms_count^⚠
• chfl_residue_contains^⚠
• chfl_residue_copy^⚠
• chfl_residue_for_atom^⚠
• chfl_residue_from_topology^⚠
• chfl_residue_get_property^⚠
• chfl_residue_id^⚠
• chfl_residue_list_properties^⚠
• chfl_residue_name^⚠
• chfl_residue_properties_count^⚠
• chfl_residue_set_property^⚠
• chfl_residue_with_id^⚠
• chfl_selection^⚠
• chfl_selection_copy^⚠
• chfl_selection_evaluate^⚠
• chfl_selection_matches^⚠
• chfl_selection_size^⚠
• chfl_selection_string^⚠
• chfl_set_warning_callback^⚠
• chfl_topology^⚠
• chfl_topology_add_atom^⚠
• chfl_topology_add_bond^⚠
• chfl_topology_add_residue^⚠
• chfl_topology_angles^⚠
• chfl_topology_angles_count^⚠
• chfl_topology_atoms_count^⚠
• chfl_topology_bond_order^⚠
• chfl_topology_bond_orders^⚠
• chfl_topology_bond_with_order^⚠
• chfl_topology_bonds^⚠
• chfl_topology_bonds_count^⚠
• chfl_topology_clear_bonds^⚠
• chfl_topology_copy^⚠
• chfl_topology_dihedrals^⚠
• chfl_topology_dihedrals_count^⚠
• chfl_topology_from_frame^⚠
• chfl_topology_impropers^⚠
• chfl_topology_impropers_count^⚠
• chfl_topology_remove^⚠
• chfl_topology_remove_bond^⚠
• chfl_topology_residues_count^⚠
• chfl_topology_residues_linked^⚠
• chfl_topology_resize^⚠
• chfl_trajectory_close^⚠
• chfl_trajectory_memory_buffer^⚠
• chfl_trajectory_memory_reader^⚠
• chfl_trajectory_memory_writer^⚠
• chfl_trajectory_nsteps^⚠
• chfl_trajectory_open^⚠
• chfl_trajectory_path^⚠
• chfl_trajectory_read^⚠
• chfl_trajectory_read_step^⚠
• chfl_trajectory_set_cell^⚠
• chfl_trajectory_set_topology^⚠
• chfl_trajectory_topology_file^⚠
• chfl_trajectory_with_format^⚠
• chfl_trajectory_write^⚠
• chfl_version^⚠

Type Aliases

• c_bool
• chfl_vector3d
• chfl_warning_callback