#include <ElecAtom.hh>

Inheritance diagram for core::scoring::hackelec::ElecAtom:

Collaboration diagram for core::scoring::hackelec::ElecAtom:

Public Types
typedef conformation::Atom	parent

Public Member Functions
	ElecAtom ()

	ElecAtom (conformation::Residue const &res, Size atom_index)

virtual	~ElecAtom ()
	non-virtual destructor to keep ElecAtom small and lightweight as a virtual destructor would add a vtable to the class But I fear leaks... do I know how xyzVector dealloates its data? More...

int	atom_type () const
	deprecated! More...

void	atom_type (int setting)
	deprecated! More...

Real	charge () const

void	charge (Real setting)

bool	is_hydrogen () const
	property required by RotamerTrie class More...

void	is_hydrogen (bool setting)
	setter method for data required by RotamerTrie class More...

void	print () const
	send a description of the atom to standard out More...

void	print (std::ostream &os) const
	send a description of the atom to an output stream More...

bool	operator< (ElecAtom const &other) const
	compairison operator for sorting More...

bool	operator== (ElecAtom const &other) const
	equality operator for shared-prefix detection More...

bool	isbb () const

Public Member Functions inherited from core::conformation::Atom
	Atom ()
	default constructor and set atom type number to 0 and place the atom at the origin More...

	Atom (ShortSize const type_in, ShortSize const mm_type_in)
	constructor with an atom type number More...

	Atom (Vector const &xyz_in, ShortSize const type_in, ShortSize const mm_type_in)
	constructor with xyz and an atom type number More...

virtual	~Atom ()
	destructor More...

void	type (ShortSize const type_in)
	set the atom type number More...

ShortSize	type () const
	Returns the AtomType number. More...

void	mm_type (ShortSize const mm_type_in)
	set the mm atom type number More...

ShortSize	mm_type () const
	get the mm atom type number More...

Vector const &	xyz () const
	Returns the atom coordinates as an xyzVector. More...

void	xyz (Vector const &xyz_in)
	Sets the atom coordinates using an xyzVector. More...

Private Attributes
bool	isbb_

bool	is_hydrogen_

Real	charge_

Detailed Description

Definition at line 32 of file ElecAtom.hh.

Member Typedef Documentation

typedef conformation::Atom core::scoring::hackelec::ElecAtom::parent

Definition at line 35 of file ElecAtom.hh.

Constructor & Destructor Documentation

core::scoring::hackelec::ElecAtom::ElecAtom ( )

Definition at line 36 of file ElecAtom.cc.

core::scoring::hackelec::ElecAtom::ElecAtom	(	conformation::Residue const &	res,
		Size	atom_index
	)

Definition at line 38 of file ElecAtom.cc.

core::scoring::hackelec::ElecAtom::~ElecAtom ( )

virtual

non-virtual destructor to keep ElecAtom small and lightweight as a virtual destructor would add a vtable to the class But I fear leaks... do I know how xyzVector dealloates its data?

Definition at line 46 of file ElecAtom.cc.