core::scoring::hackelec::ElecAtom Class Reference

#include <ElecAtom.hh>

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

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

List of all members.

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?
int	atom_type () const
	deprecated!
void	atom_type (int setting)
	deprecated!
Real	charge () const
void	charge (Real setting)
bool	is_hydrogen () const
	property required by RotamerTrie class
void	is_hydrogen (bool setting)
	setter method for data required by RotamerTrie class
void	print () const
	send a description of the atom to standard out
void	print (std::ostream &os) const
	send a description of the atom to an output stream
bool	operator< (ElecAtom const &other) const
	compairison operator for sorting
bool	operator== (ElecAtom const &other) const
	equality operator for shared-prefix detection
bool	isbb () const

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Member Typedef Documentation

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

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Constructor & Destructor Documentation

core::scoring::hackelec::ElecAtom::ElecAtom

(

)

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

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?

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Member Function Documentation

int core::scoring::hackelec::ElecAtom::atom_type

(

)

const [inline]

deprecated!

References core::conformation::Atom::type().

void core::scoring::hackelec::ElecAtom::atom_type

(

int

setting

)

[inline]

deprecated!

References core::conformation::Atom::type().

void core::scoring::hackelec::ElecAtom::charge

(

Real

setting

)

[inline]

Real core::scoring::hackelec::ElecAtom::charge

(

)

const [inline]

Referenced by core::scoring::hackelec::HackElecEnergy::heavyatom_heavyatom_energy(), core::scoring::hackelec::HackElecEnergy::heavyatom_hydrogenatom_energy(), core::scoring::hackelec::HackElecEnergy::hydrogenatom_heavyatom_energy(), and core::scoring::hackelec::HackElecEnergy::hydrogenatom_hydrogenatom_energy().

bool core::scoring::hackelec::ElecAtom::is_hydrogen

(

)

const [inline]

property required by RotamerTrie class

void core::scoring::hackelec::ElecAtom::is_hydrogen

(

bool

setting

)

[inline]

setter method for data required by RotamerTrie class

bool core::scoring::hackelec::ElecAtom::isbb

(

)

const [inline]

Referenced by core::scoring::hackelec::HackElecEnergy::heavyatom_heavyatom_energy(), core::scoring::hackelec::HackElecEnergy::heavyatom_hydrogenatom_energy(), core::scoring::hackelec::HackElecEnergy::hydrogenatom_heavyatom_energy(), core::scoring::hackelec::HackElecEnergy::hydrogenatom_hydrogenatom_energy(), operator<(), and operator==().

bool core::scoring::hackelec::ElecAtom::operator<

(

ElecAtom const &

other

)

const [inline]

compairison operator for sorting

References isbb(), core::conformation::Atom::type(), and core::conformation::Atom::xyz().

bool core::scoring::hackelec::ElecAtom::operator==

(

ElecAtom const &

other

)

const [inline]

equality operator for shared-prefix detection

References isbb(), core::conformation::Atom::type(), and core::conformation::Atom::xyz().

void core::scoring::hackelec::ElecAtom::print

(

)

const

send a description of the atom to standard out

Referenced by core::scoring::hackelec::operator<<().

void core::scoring::hackelec::ElecAtom::print

(

std::ostream &

os

)

const

send a description of the atom to an output stream

References core::conformation::Atom::type(), and core::conformation::Atom::xyz().

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The documentation for this class was generated from the following files:

• src/core/scoring/hackelec/ElecAtom.hh
• src/core/scoring/hackelec/ElecAtom.cc