dsrpdb::Residue_data Namespace Reference

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Detailed Description

This namespace holds the data for initializating residue data.

Classes
struct	Amino_acid_data
	This structure is used to store the bonds and atoms in each residue type. More...
class	Atom_data
	This is the mapping between strings dsrpdb::Residue::Atom_label and dsrpdb::Atom::Type. More...
struct	Residue_init_data
	This structure is used to initialize the per-residue atom and bond data. More...
struct	Atom_fallback_data
	This struct is used to map between alternate names of atoms. More...
Typedefs
typedef std::pair< Residue::Atom_label, Residue::Atom_label >	Possible_bond
Functions
void	initialize ()
Variables
Atom_data	clean_atom_name_data_ []

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Typedef Documentation

typedef std::pair<Residue::Atom_label, Residue::Atom_label> dsrpdb::Residue_data::Possible_bond

A bond which might be in the residue. Bonds might not be there due to missing atoms. Definition at line 14 of file Residue_data.h.

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Variable Documentation

Atom_data dsrpdb::Residue_data::clean_atom_name_data_[]

This is the mapping between atom string names in the pdb and atom labels. See Residue_data.cc to change this.