T_Atom_with_flat_info< NT > Class Template Reference

Wrapper representing the atom. More...

#include <Atom_with_flat_info_traits.hpp>

Public Types
typedef T_Atom_with_flat_info< NT >	Self
typedef NT	FT

Public Member Functions
	T_Atom_with_flat_info (void)
template<class ParticleBase >
	T_Atom_with_flat_info (const ParticleBase &particle)
bool	is_fake (void) const
unsigned	get_index (void) const
bool	is_atom (void) const
bool	is_hetatm (void) const
unsigned	atom_serial_number (void) const
const std::string &	atom_name (void) const
	Returns the PDB name of the atom. More...
char	alternate_location (void) const
const std::string &	residue_name (void) const
	Returns the name of the residue containing this atom. More...
char	chain_identifier (void) const
int	residue_sequence_number (void) const
char	insertion_code (void) const
const FT &	x (void) const
const FT &	y (void) const
const FT &	z (void) const
const FT &	occupancy (void) const
const FT &	temperature_factor (void) const
const std::string &	element (void) const
int	charge (void) const
int	system_index (void) const
template<class ParticleType >
void	build (const ParticleType &particle)
void	build (const Self &particle)
void	build (void)
std::string	to_pdb (void) const
template<class Archive >
void	serialize (Archive &ar, const unsigned version)

Detailed Description

template<class NT>
class SBL::Models::T_Atom_with_flat_info< NT >

Wrapper representing the atom.

In particular, the data structure is serializible.

Member Typedef Documentation

FT

typedef NT FT

Self

typedef T_Atom_with_flat_info<NT> Self

Constructor & Destructor Documentation

T_Atom_with_flat_info() [1/2]

T_Atom_with_flat_info ( void  )

inline

T_Atom_with_flat_info() [2/2]

T_Atom_with_flat_info ( const ParticleBase &  particle )

inline

Member Function Documentation

alternate_location()

char alternate_location ( void  ) const

inline

atom_name()

const std::string& atom_name ( void  ) const

inline

Returns the PDB name of the atom.

atom_serial_number()

unsigned atom_serial_number ( void  ) const

inline

build() [1/3]

void build ( const ParticleType &  particle )

inline

build() [2/3]

void build ( const Self &  particle )

inline

build() [3/3]

void build ( void  )

inline

chain_identifier()

char chain_identifier ( void  ) const

inline

charge()

int charge ( void  ) const

inline

element()

const std::string& element ( void  ) const

inline

get_index()

unsigned get_index ( void  ) const

inline

insertion_code()

char insertion_code ( void  ) const

inline

is_atom()

bool is_atom ( void  ) const

inline

is_fake()

bool is_fake ( void  ) const

inline

is_hetatm()

bool is_hetatm ( void  ) const

inline

occupancy()

const FT& occupancy ( void  ) const

inline

residue_name()

const std::string& residue_name ( void  ) const

inline

Returns the name of the residue containing this atom.

residue_sequence_number()

int residue_sequence_number ( void  ) const

inline

serialize()

void serialize ( Archive &  ar, const unsigned  version  )

inline

system_index()

int system_index ( void  ) const

inline

temperature_factor()

const FT& temperature_factor ( void  ) const

inline

to_pdb()

std::string to_pdb ( void  ) const

inline

x()

const FT& x ( void  ) const

inline

y()

const FT& y ( void  ) const

inline

z()

const FT& z ( void  ) const

inline