protocols::sewing::requirements::KeepLigandContactsRequirement Class Reference

a Requirement that an Assembly have less than a certain number of clashes More...

#include <KeepLigandContactsRequirement.hh>

Inheritance diagram for protocols::sewing::requirements::KeepLigandContactsRequirement:

Public Member Functions
	KeepLigandContactsRequirement ()
	KeepLigandContactsRequirement (KeepLigandContactsRequirement const &src)
	~KeepLigandContactsRequirement () override
KeepLigandContactsRequirementOP	clone () const
std::pair< bool, bool >	test (data_storage::SmartAssemblyOP assembly) override
std::string	get_name () override
void	set_options_from_tag (utility::tag::TagCOP requirement_tag, basic::datacache::DataMap &datamap) override
core::Real	get_contact_distance_cutoff () const
void	set_contact_distance_cutoff (core::Real)
Public Member Functions inherited from protocols::sewing::requirements::AssemblyRequirement
virtual	~AssemblyRequirement ()=default
	Destructor. More...
	AssemblyRequirement ()=default
	Prevent direct instantiation: No other constructors allowed. More...
	AssemblyRequirement (AssemblyRequirement const &)=default

Static Public Member Functions
static void	provide_xml_schema (utility::tag::XMLSchemaDefinition &)
static utility::tag::AttributeList	get_xml_attributes ()
static std::string	type_name ()

Private Attributes
core::Real	contact_distance_cutoff_ =2.0
std::pair< bool, bool >	test_results_

Detailed Description

a Requirement that an Assembly have less than a certain number of clashes

Constructor & Destructor Documentation

protocols::sewing::requirements::KeepLigandContactsRequirement::KeepLigandContactsRequirement

(

)

References contact_distance_cutoff_.

protocols::sewing::requirements::KeepLigandContactsRequirement::KeepLigandContactsRequirement

(

KeepLigandContactsRequirement const &

src

)

References contact_distance_cutoff_.

protocols::sewing::requirements::KeepLigandContactsRequirement::~KeepLigandContactsRequirement ( )

override

Member Function Documentation

KeepLigandContactsRequirementOP protocols::sewing::requirements::KeepLigandContactsRequirement::clone

(

)

const

core::Real protocols::sewing::requirements::KeepLigandContactsRequirement::get_contact_distance_cutoff

(

)

const

References contact_distance_cutoff_.

std::string protocols::sewing::requirements::KeepLigandContactsRequirement::get_name ( )

inlineoverridevirtual

Implements protocols::sewing::requirements::AssemblyRequirement.

References type_name().

utility::tag::AttributeList protocols::sewing::requirements::KeepLigandContactsRequirement::get_xml_attributes ( )

static

Referenced by provide_xml_schema().

void protocols::sewing::requirements::KeepLigandContactsRequirement::provide_xml_schema ( utility::tag::XMLSchemaDefinition &  xsd )

static

References protocols::sewing::requirements::AssemblyRequirementFactory::assembly_requirement_ct_namer(), get_xml_attributes(), and type_name().

Referenced by protocols::sewing::requirements::KeepLigandContactsRequirementCreator::provide_xml_schema().

void protocols::sewing::requirements::KeepLigandContactsRequirement::set_contact_distance_cutoff

(

core::Real

setting

)

References contact_distance_cutoff_.

void protocols::sewing::requirements::KeepLigandContactsRequirement::set_options_from_tag ( utility::tag::TagCOP  requirement_tag, basic::datacache::DataMap &  datamap  )

overridevirtual

Implements protocols::sewing::requirements::AssemblyRequirement.

References contact_distance_cutoff_, and protocols::sewing::requirements::TR().

std::pair< bool, bool > protocols::sewing::requirements::KeepLigandContactsRequirement::test ( data_storage::SmartAssemblyOP  assembly )

overridevirtual

Implements protocols::sewing::requirements::AssemblyRequirement.

References contact_distance_cutoff_, and core::kinematics::distance().

std::string protocols::sewing::requirements::KeepLigandContactsRequirement::type_name ( )

static

Referenced by get_name(), protocols::sewing::requirements::KeepLigandContactsRequirementCreator::keyname(), and provide_xml_schema().

Member Data Documentation

core::Real protocols::sewing::requirements::KeepLigandContactsRequirement::contact_distance_cutoff_ =2.0

private

Referenced by get_contact_distance_cutoff(), KeepLigandContactsRequirement(), set_contact_distance_cutoff(), set_options_from_tag(), and test().

std::pair<bool,bool> protocols::sewing::requirements::KeepLigandContactsRequirement::test_results_

private

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The documentation for this class was generated from the following files:

• src/protocols/sewing/requirements/KeepLigandContactsRequirement.hh
• src/protocols/sewing/requirements/KeepLigandContactsRequirement.cc