exclusions.hpp File Reference

#include "config/config.hpp"
#include "Particle.hpp"
#include <algorithm>

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Functions
bool	do_nonbonded (Particle const &p1, Particle const &p2)
	Determine if the non-bonded interactions between p1 and p2 should be calculated.
void	delete_exclusion (Particle &p, int p_id)
	Remove exclusion from particle if possible.
void	add_exclusion (Particle &p, int p_id)
	Insert an exclusion if not already set.

Function Documentation

add_exclusion()

void add_exclusion	(	Particle &	p,
		int	p_id
	)

Insert an exclusion if not already set.

Definition at line 34 of file exclusions.cpp.

References Utils::contains(), and Particle::exclusions().

Referenced by ScriptInterface::Particles::auto_exclusions(), and ScriptInterface::Particles::local_add_exclusion().

delete_exclusion()

void delete_exclusion	(	Particle &	p,
		int	p_id
	)

Remove exclusion from particle if possible.

Definition at line 41 of file exclusions.cpp.

References Particle::exclusions().

Referenced by ScriptInterface::Particles::local_remove_exclusion().

do_nonbonded()

bool do_nonbonded ( Particle const &  p1, Particle const &  p2  )

inline

Determine if the non-bonded interactions between p1 and p2 should be calculated.

Definition at line 35 of file exclusions.hpp.

References Particle::exclusions(), and Particle::id().

Referenced by add_non_bonded_pair_energy(), add_non_bonded_pair_force(), add_non_bonded_pair_virials(), ForcesKernel::operator()(), and System::System::particle_short_range_energy_contribution().