Only used for deriving interface. More...

#include <BALL/MOLMEC/COMMON/assignTypes.h>

Inheritance diagram for BALL::AssignBaseProcessor:

Public Member Functions
	AssignBaseProcessor ()
void	setMaximumUnassignedAtoms (Size nr)
Size	getMaximumUnassignedAtoms () const
Size	getNumberOfUnassignedAtoms () const
	Get the number of atoms, for which the force field setup failed.
HashSet< const Atom * > &	getUnassignedAtoms ()
	Get the atoms, for which the force field setup failed.
Public Member Functions inherited from BALL::UnaryProcessor< Atom >
	UnaryProcessor ()
	UnaryProcessor (const UnaryProcessor &)
virtual	~UnaryProcessor ()
virtual bool	start ()
virtual bool	finish ()
virtual Processor::Result	operator() (Atom &)

Protected Attributes
HashSet< const Atom * >	unassigned_atoms_
Size	max_number_unassigned_atoms_

Additional Inherited Members
Public Types inherited from BALL::UnaryFunctor< ArgumentType, ResultType >
typedef ResultType	result_type
typedef ArgumentType	argument_type
typedef ArgumentType &	argument_reference
typedef const ArgumentType &	const_argument_reference
typedef ArgumentType *	argument_pointer
typedef const ArgumentType *	const_argument_pointer

Detailed Description

Only used for deriving interface.

Definition at line 25 of file assignTypes.h.

Constructor & Destructor Documentation

◆ AssignBaseProcessor()

BALL::AssignBaseProcessor::AssignBaseProcessor ( )

Member Function Documentation

◆ getMaximumUnassignedAtoms()

Size BALL::AssignBaseProcessor::getMaximumUnassignedAtoms ( ) const

Get the number of atoms, for which the setup of the forcefield can fail, until the setup() methods aborts and return false.

◆ getNumberOfUnassignedAtoms()

Size BALL::AssignBaseProcessor::getNumberOfUnassignedAtoms ( ) const

Get the number of atoms, for which the force field setup failed.

◆ getUnassignedAtoms()

HashSet< const Atom * > & BALL::AssignBaseProcessor::getUnassignedAtoms ( )

Get the atoms, for which the force field setup failed.

◆ setMaximumUnassignedAtoms()

void BALL::AssignBaseProcessor::setMaximumUnassignedAtoms ( Size nr )

Set the number of atoms, for which the setup of the forcefield can fail, until the setup() methods aborts and return false. By default, there is no limit set.

Member Data Documentation

◆ max_number_unassigned_atoms_

Size BALL::AssignBaseProcessor::max_number_unassigned_atoms_

protected

Definition at line 56 of file assignTypes.h.

◆ unassigned_atoms_

HashSet<const Atom*> BALL::AssignBaseProcessor::unassigned_atoms_