Select_by_element Struct Reference

#include <atom_selectors.h>

Public Member Functions
	Select_by_element ()
	Select_by_element (const std::string &str)
template<class Atom >
bool	operator() (const Atom &atom) const

Detailed Description

Function object to select an atom using its chemical name.

Constructor & Destructor Documentation

Select_by_element() [1/2]

Select_by_element ( )

inline

Default constructor

Select_by_element() [2/2]

Select_by_element ( const std::string &  str )

inline

Constructor.

Parameters

str	is the chemical name of the atoms to be selected.

Member Function Documentation

operator()()

bool operator() ( const Atom &  atom ) const

inline

Checks if an atoms match a criteria.

Template Parameters

Atom	must represent an atom, a global function ESBTL::get_element taking an element of this type must exits.

Parameters

atom	represents an atom.