Inheritance diagram for ScriptInterface::Interactions::InteractionThole:

Collaboration diagram for ScriptInterface::Interactions::InteractionThole:

Public Member Functions
	InteractionThole ()

Public Member Functions inherited from ScriptInterface::Interactions::InteractionPotentialInterface<::Thole_Parameters >
Variant	do_call_method (std::string const &name, VariantMap const &params) override

void	do_construct (VariantMap const &params) final

void	attach (std::weak_ptr< NonBondedInteractionHandle * > si_struct, std::weak_ptr<::IA_parameters > core_struct)

void	update_core (bool notify=true)

Public Member Functions inherited from ScriptInterface::AutoParameters< Derived, Base >
std::span< const boost::string_ref >	valid_parameters () const final

Variant	get_parameter (const std::string &name) const final

void	do_set_parameter (const std::string &name, const Variant &value) final

std::vector< std::pair< std::string, Variant > >	serialize_parameters () const final

Public Member Functions inherited from ScriptInterface::ObjectHandle
	ObjectHandle ()=default

	ObjectHandle (ObjectHandle const &)=delete

ObjectHandle &	operator= (ObjectHandle const &)=delete

virtual	~ObjectHandle ()=default

boost::string_ref	name () const

Context *	context () const
	Responsible context.

void	construct (VariantMap const &params)
	Construct the handled object.

VariantMap	get_parameters () const
	Get current parameters.

auto	get_valid_parameters () const

void	set_parameter (const std::string &name, const Variant &value)
	Set single parameter.

Variant	call_method (const std::string &name, const VariantMap &params)
	Call a method on the object.

std::string	serialize () const

Protected Member Functions
CoreInteraction IA_parameters::*	get_ptr_offset () const override

Protected Member Functions inherited from ScriptInterface::Interactions::InteractionPotentialInterface<::Thole_Parameters >
auto	make_autoparameter (T CoreInteraction::ptr, char const name)

Protected Member Functions inherited from ScriptInterface::AutoParameters< Derived, Base >
	AutoParameters ()=default

	AutoParameters (std::vector< AutoParameter > &&params)

void	add_parameters (std::vector< AutoParameter > &&params)

auto const &	get_parameter_insertion_order () const

Private Member Functions
std::string	inactive_parameter () const override

double	inactive_cutoff () const override

void	make_new_instance (VariantMap const &params) override

Additional Inherited Members
Public Types inherited from ScriptInterface::Interactions::InteractionPotentialInterface<::Thole_Parameters >
using	CoreInteraction = ::Thole_Parameters

Static Public Member Functions inherited from ScriptInterface::ObjectHandle
static ObjectRef	deserialize (const std::string &state, Context &ctx)
	Make object from serialized state.

Protected Types inherited from ScriptInterface::Interactions::InteractionPotentialInterface<::Thole_Parameters >
using	BaseClass = AutoParameters< InteractionPotentialInterface< ::Thole_Parameters > >

Protected Attributes inherited from ScriptInterface::Interactions::InteractionPotentialInterface<::Thole_Parameters >
std::shared_ptr< CoreInteraction >	m_handle
	Managed object.

std::weak_ptr<::IA_parameters >	m_core_struct
	Handle to the container whose members have to be synchronized.

std::weak_ptr< NonBondedInteractionHandle * >	m_si_struct
	Handle to the interface used to synchronize data members.

std::weak_ptr< std::function< void()> >	m_notify_non_bonded_ia_change
	Callback to notify changes to the interaction range.