#include <RestrictToInterfaceVectorOperation.hh>

Inheritance diagram for protocols::toolbox::task_operations::RestrictToInterfaceVectorOperation:

Collaboration diagram for protocols::toolbox::task_operations::RestrictToInterfaceVectorOperation:

Public Types
typedef InterfaceTaskOperation	parent

Public Types inherited from protocols::toolbox::task_operations::InterfaceTaskOperation
typedef core::pack::task::operation::TaskOperation	TaskOperation

typedef core::pack::task::operation::TaskOperationOP	TaskOperationOP

typedef TaskOperation	parent

Public Types inherited from core::pack::task::operation::TaskOperation
typedef utility::tag::TagPtr	TagPtr

typedef pose::Pose	Pose

Public Member Functions
	RestrictToInterfaceVectorOperation ()

	RestrictToInterfaceVectorOperation (core::Size const lower_chain_id, core::Size const upper_chain_id)
	this ctor will generate the calculator for you (may use defaults) if you want to use chain characters make the calculator that way and pass it to the constructor above More...

	RestrictToInterfaceVectorOperation (core::Size const lower_chain, core::Size const upper_chain, core::Real CB_dist_cutoff, core::Real nearby_atom_cutoff, core::Real vector_angle_cutoff, core::Real vector_dist_cutoff)

	RestrictToInterfaceVectorOperation (utility::vector1_int const movable_jumps)
	this ctor will generate the calculator for you (may use defaults) if you want to use chain characters make the calculator that way and pass it to the constructor above More...

	RestrictToInterfaceVectorOperation (utility::vector1_int const movable_jumps, core::Real CB_dist_cutoff, core::Real nearby_atom_cutoff, core::Real vector_angle_cutoff, core::Real vector_dist_cutoff)

virtual	~RestrictToInterfaceVectorOperation ()

virtual TaskOperationOP	clone () const

virtual void	apply (core::pose::Pose const &, core::pack::task::PackerTask &) const

void	upper_chain (core::Size upper_chain)

void	lower_chain (core::Size lower_chain)

void	upper_chain (utility::vector1< core::Size > upper_chain)

void	lower_chain (utility::vector1< core::Size > lower_chain)

void	CB_dist_cutoff (core::Real CB_dist_cutoff)
	Commenting out to fix PyRosetta build void jump_num( int jump_num);. More...

void	nearby_atom_cutoff (core::Real nearby_atom_cutoff)

void	vector_angle_cutoff (core::Real vector_angle_cutoff)

void	vector_dist_cutoff (core::Real vector_dist_cutoff)

void	parse_tag (TagPtr tag)
	parse_tag function for rosetta scripts More...

Public Member Functions inherited from protocols::toolbox::task_operations::InterfaceTaskOperation
	InterfaceTaskOperation ()

	InterfaceTaskOperation (InterfaceTaskOperation const &old_instance)

virtual	~InterfaceTaskOperation ()

void	set_movable_jumps (utility::vector1_int const &movable_jumps)

void	add_movable_jump (int const additional_jump)

utility::vector1_int const &	movable_jumps () const

Public Member Functions inherited from core::pack::task::operation::TaskOperation
virtual	~TaskOperation ()

virtual void	parse_def (utility::lua::LuaObject const &def)

Private Attributes
utility::vector1< core::Size >	lower_chains_
	private data used to pass to the definition function More...

utility::vector1< core::Size >	upper_chains_

bool	jump_active_

core::Real	CB_dist_cutoff_

core::Real	nearby_atom_cutoff_

core::Real	vector_angle_cutoff_

core::Real	vector_dist_cutoff_

Detailed Description

this class is a TaskOperation to prevent repacking of residues not near an interface.

Definition at line 42 of file RestrictToInterfaceVectorOperation.hh.

Member Typedef Documentation

typedef InterfaceTaskOperation protocols::toolbox::task_operations::RestrictToInterfaceVectorOperation::parent

Definition at line 45 of file RestrictToInterfaceVectorOperation.hh.

Constructor & Destructor Documentation

protocols::toolbox::task_operations::RestrictToInterfaceVectorOperation::RestrictToInterfaceVectorOperation ( )

, empty contructor for parser

Definition at line 53 of file RestrictToInterfaceVectorOperation.cc.

Referenced by clone().

protocols::toolbox::task_operations::RestrictToInterfaceVectorOperation::RestrictToInterfaceVectorOperation	(	core::Size const	lower_chain_id,
		core::Size const	upper_chain_id
	)

this ctor will generate the calculator for you (may use defaults) if you want to use chain characters make the calculator that way and pass it to the constructor above

Definition at line 69 of file RestrictToInterfaceVectorOperation.cc.

References lower_chain(), and upper_chain().

protocols::toolbox::task_operations::RestrictToInterfaceVectorOperation::RestrictToInterfaceVectorOperation	(	core::Size const	lower_chain,
		core::Size const	upper_chain,
		core::Real	CB_dist_cutoff,
		core::Real	nearby_atom_cutoff,
		core::Real	vector_angle_cutoff,
		core::Real	vector_dist_cutoff
	)

Definition at line 83 of file RestrictToInterfaceVectorOperation.cc.

References lower_chain(), and upper_chain().

protocols::toolbox::task_operations::RestrictToInterfaceVectorOperation::RestrictToInterfaceVectorOperation ( utility::vector1_int const movable_jumps)

this ctor will generate the calculator for you (may use defaults) if you want to use chain characters make the calculator that way and pass it to the constructor above

Definition at line 104 of file RestrictToInterfaceVectorOperation.cc.

References protocols::toolbox::task_operations::InterfaceTaskOperation::set_movable_jumps().

protocols::toolbox::task_operations::RestrictToInterfaceVectorOperation::RestrictToInterfaceVectorOperation	(	utility::vector1_int const	movable_jumps,
		core::Real	CB_dist_cutoff,
		core::Real	nearby_atom_cutoff,
		core::Real	vector_angle_cutoff,
		core::Real	vector_dist_cutoff
	)

Definition at line 114 of file RestrictToInterfaceVectorOperation.cc.

References protocols::toolbox::task_operations::InterfaceTaskOperation::set_movable_jumps().

protocols::toolbox::task_operations::RestrictToInterfaceVectorOperation::~RestrictToInterfaceVectorOperation ( )

virtual

Definition at line 132 of file RestrictToInterfaceVectorOperation.cc.

Member Function Documentation

void protocols::toolbox::task_operations::RestrictToInterfaceVectorOperation::apply	(	core::pose::Pose const &	pose,
		core::pack::task::PackerTask &	task
	)		const

virtual

apply function, uses inherited functionality

Implements core::pack::task::operation::TaskOperation.

Definition at line 149 of file RestrictToInterfaceVectorOperation.cc.

References core::pack::task::operation::util::calc_interface_vector(), CB_dist_cutoff_, jump_active_, lower_chains_, protocols::toolbox::task_operations::InterfaceTaskOperation::movable_jumps(), nearby_atom_cutoff_, core::pack::task::PackerTask::restrict_to_residues(), core::pose::Pose::total_residue(), protocols::TR(), upper_chains_, vector_angle_cutoff_, and vector_dist_cutoff_.

void protocols::toolbox::task_operations::RestrictToInterfaceVectorOperation::CB_dist_cutoff ( core::Real CB_dist_cutoff)

Commenting out to fix PyRosetta build void jump_num( int jump_num);.

Definition at line 248 of file RestrictToInterfaceVectorOperation.cc.

References CB_dist_cutoff_.

Referenced by parse_tag().

core::pack::task::operation::TaskOperationOP protocols::toolbox::task_operations::RestrictToInterfaceVectorOperation::clone ( ) const

virtual

be warned if you use clone that you'll not get a new interface calculator

Implements core::pack::task::operation::TaskOperation.

Definition at line 141 of file RestrictToInterfaceVectorOperation.cc.

References RestrictToInterfaceVectorOperation().

void protocols::toolbox::task_operations::RestrictToInterfaceVectorOperation::lower_chain ( core::Size lower_chain)

Definition at line 229 of file RestrictToInterfaceVectorOperation.cc.

References jump_active_, and lower_chains_.

Referenced by lower_chain(), parse_tag(), and RestrictToInterfaceVectorOperation().

void protocols::toolbox::task_operations::RestrictToInterfaceVectorOperation::lower_chain ( utility::vector1< core::Size > lower_chain)

Definition at line 238 of file RestrictToInterfaceVectorOperation.cc.

References jump_active_, lower_chain(), and lower_chains_.

void protocols::toolbox::task_operations::RestrictToInterfaceVectorOperation::nearby_atom_cutoff ( core::Real nearby_atom_cutoff)

Definition at line 252 of file RestrictToInterfaceVectorOperation.cc.

References nearby_atom_cutoff_.

Referenced by parse_tag().

void protocols::toolbox::task_operations::RestrictToInterfaceVectorOperation::parse_tag ( TagPtr tag)

virtual

parse_tag function for rosetta scripts

parse_tag function for the parser, sets reasonable values for all options

Reimplemented from core::pack::task::operation::TaskOperation.

Definition at line 277 of file RestrictToInterfaceVectorOperation.cc.

References CB_dist_cutoff(), jump_active_, lower_chain(), nearby_atom_cutoff(), protocols::toolbox::task_operations::InterfaceTaskOperation::set_movable_jumps(), protocols::TR(), upper_chain(), vector_angle_cutoff(), and vector_dist_cutoff().

void protocols::toolbox::task_operations::RestrictToInterfaceVectorOperation::upper_chain ( core::Size upper_chain)

setters: only exist to pass info from the parser

Definition at line 214 of file RestrictToInterfaceVectorOperation.cc.

References jump_active_, and upper_chains_.

Referenced by parse_tag(), RestrictToInterfaceVectorOperation(), and upper_chain().

void protocols::toolbox::task_operations::RestrictToInterfaceVectorOperation::upper_chain ( utility::vector1< core::Size > upper_chain)

Definition at line 222 of file RestrictToInterfaceVectorOperation.cc.

References jump_active_, upper_chain(), and upper_chains_.

void protocols::toolbox::task_operations::RestrictToInterfaceVectorOperation::vector_angle_cutoff ( core::Real vector_angle_cutoff)

Definition at line 256 of file RestrictToInterfaceVectorOperation.cc.

References vector_angle_cutoff_.

Referenced by parse_tag().

void protocols::toolbox::task_operations::RestrictToInterfaceVectorOperation::vector_dist_cutoff ( core::Real vector_dist_cutoff)

Definition at line 260 of file RestrictToInterfaceVectorOperation.cc.

References vector_dist_cutoff_.

Referenced by parse_tag().

Member Data Documentation

core::Real protocols::toolbox::task_operations::RestrictToInterfaceVectorOperation::CB_dist_cutoff_

private

Definition at line 111 of file RestrictToInterfaceVectorOperation.hh.

Referenced by apply(), and CB_dist_cutoff().

bool protocols::toolbox::task_operations::RestrictToInterfaceVectorOperation::jump_active_

private

Definition at line 108 of file RestrictToInterfaceVectorOperation.hh.

Referenced by apply(), lower_chain(), parse_tag(), and upper_chain().

utility::vector1<core::Size> protocols::toolbox::task_operations::RestrictToInterfaceVectorOperation::lower_chains_

private

private data used to pass to the definition function

Definition at line 106 of file RestrictToInterfaceVectorOperation.hh.

Referenced by apply(), and lower_chain().

core::Real protocols::toolbox::task_operations::RestrictToInterfaceVectorOperation::nearby_atom_cutoff_

private

Definition at line 112 of file RestrictToInterfaceVectorOperation.hh.

Referenced by apply(), and nearby_atom_cutoff().

utility::vector1<core::Size> protocols::toolbox::task_operations::RestrictToInterfaceVectorOperation::upper_chains_

private

Definition at line 107 of file RestrictToInterfaceVectorOperation.hh.

Referenced by apply(), and upper_chain().

core::Real protocols::toolbox::task_operations::RestrictToInterfaceVectorOperation::vector_angle_cutoff_

private

Definition at line 113 of file RestrictToInterfaceVectorOperation.hh.

Referenced by apply(), and vector_angle_cutoff().

core::Real protocols::toolbox::task_operations::RestrictToInterfaceVectorOperation::vector_dist_cutoff_

private

Definition at line 114 of file RestrictToInterfaceVectorOperation.hh.

Referenced by apply(), and vector_dist_cutoff().

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

src/protocols/toolbox/task_operations/RestrictToInterfaceVectorOperation.hh
src/protocols/toolbox/task_operations/RestrictToInterfaceVectorOperation.cc

Public Types

Public Member Functions

Private Attributes

Detailed Description

Member Typedef Documentation

Constructor & Destructor Documentation

Member Function Documentation

Member Data Documentation