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Rosetta
3.8
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#include <MPRangeRelaxMover.hh>
Public Member Functions | |
MPRangeRelaxMover () | |
Constructors ///. More... | |
MPRangeRelaxMover (MPRangeRelaxMover const &src) | |
Copy Constructor. More... | |
MPRangeRelaxMover & | operator= (MPRangeRelaxMover const &src) |
Assignment Operator. More... | |
virtual | ~MPRangeRelaxMover () |
Destructor. More... | |
virtual protocols::moves::MoverOP | clone () const |
Rosetta Scripts Methods ///. More... | |
virtual protocols::moves::MoverOP | fresh_instance () const |
Create a Fresh Instance of this Mover. More... | |
void | parse_my_tag (utility::tag::TagCOP tag, basic::datacache::DataMap &, protocols::filters::Filters_map const &, protocols::moves::Movers_map const &, core::pose::Pose const &) |
Pase Rosetta Scripts Options for this Mover. More... | |
virtual std::string | get_name () const |
Mover Methods ///. More... | |
virtual void | apply (Pose &pose) |
Do a RangeRelax of a membrane protein. More... | |
void | optimize_membrane (bool yesno) |
Optimize membrane. More... | |
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Mover () | |
~Mover () override | |
virtual MoverOP | create () |
MoverCOP | get_self_ptr () const |
MoverOP | get_self_ptr () |
MoverCAP | get_self_weak_ptr () const |
MoverAP | get_self_weak_ptr () |
Mover (std::string type_name) | |
sets the type for a mover; name_ has been removed (2010/05/14) More... | |
Mover (Mover const &other) | |
Mover & | operator= (Mover const &other) |
assignment operator More... | |
virtual core::Real | last_proposal_density_ratio () |
std::string const & | type () const |
void | set_type (std::string const &setting) |
std::string | get_current_tag () const |
A tag is a unique identifier used to identify structures produced by this Mover. get_current_tag() returns the tag, and set_current_tag( std::string tag ) sets the tag. This functionality is not intended for use with the 2008 job distributor. More... | |
virtual void | set_current_tag (std::string const &new_tag) |
virtual void | set_input_pose (PoseCOP pose) |
setter for poses contained for rms More... | |
virtual void | set_native_pose (PoseCOP pose) |
setter for native poses contained for rms -— we should get rid of this method? it is widely used, but a bit unsafe More... | |
PoseCOP | get_input_pose () const |
PoseCOP | get_native_pose () const |
virtual void | test_move (Pose &pose) |
: Unit test support function. Apply one move to a given pose. Allows extra test specific functions to be called before applying More... | |
void | type (const std::string &type_in) |
std::string | get_type () const |
MoverStatus | get_last_move_status () const |
end parser interface, start Job Distributor interface///////////// More... | |
void | reset_status () |
resets status to SUCCESS, meant to be used before an apply(). The job distributor (august 08 vintage) uses this to ensure non-accumulation of status across apply()s. More... | |
virtual core::pose::PoseOP | get_additional_output () |
Mechanism by which a mover may return multiple output poses from a single input pose. More... | |
virtual void | clear_info () |
Strings container can be used to return miscellaneous info (as std::string) from a mover, such as notes about the results of apply(). The job distributor (Apr 09 vintage) will check this function to see if your protocol wants to add string info to the Job that ran this mover. One way this can be useful is that later, a JobOutputter may include/append this info to an output file. More... | |
virtual Strings & | info () |
non-const accessor More... | |
virtual Strings const & | info () const |
const accessor More... | |
virtual bool | reinitialize_for_each_job () const |
Inform the Job Distributor (August '08 vintage) whether this object needs to be freshly regenerated on each use. More... | |
virtual bool | reinitialize_for_new_input () const |
Inform the Job Distributor (August '08 vintage) whether this object needs to be regenerated when the input pose is about to change, (for example, if the Mover has special code on the first apply() that is only valid for that one input pose). More... | |
void | set_current_job (protocols::jobdist::BasicJobCOP job) |
jobdist::BasicJobCOP | get_current_job () const |
virtual void | show (std::ostream &output=std::cout) const |
Outputs details about the Mover, including current settings. More... | |
Private Member Functions | |
void | register_options () |
Setup Methods ///. More... | |
void | set_defaults () |
Set default values. More... | |
void | init_from_cmd () |
Init from commandline. More... | |
Private Attributes | |
core::pose::PoseOP | native_ |
Native. More... | |
core::scoring::ScoreFunctionOP | sfxn_ |
Scorefxn. More... | |
core::Size | center_resnumber_ |
Center residue number. More... | |
bool | set_tm_helical_ |
Set helical secondary structure in TM region. More... | |
bool | optmem_ |
optimize membrane? More... | |
Additional Inherited Members | |
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typedef utility::tag::TagCOP | TagCOP |
typedef core::pose::Pose | Pose |
typedef core::pose::PoseCOP | PoseCOP |
typedef protocols::filters::Filters_map | Filters_map |
typedef std::list< std::string > | Strings |
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static std::string | name () |
static void | register_options () |
Overload this static method if you access options within the mover. More... | |
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void | set_last_move_status (MoverStatus status) |
nonvirtual setter for MoverStatus last_status_. Protected means that only the mover itself will be able to change its own status. The job distributor (august 08 vintage) is aware of status set with this function and will do what the MoverStatus says. More... | |
protocols::relax::membrane::MPRangeRelaxMover::MPRangeRelaxMover | ( | ) |
Constructors ///.
Default Constructor
References init_from_cmd(), register_options(), and set_defaults().
Referenced by clone(), fresh_instance(), and operator=().
protocols::relax::membrane::MPRangeRelaxMover::MPRangeRelaxMover | ( | MPRangeRelaxMover const & | src | ) |
Copy Constructor.
Create a deep copy of this mover
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Destructor.
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Do a RangeRelax of a membrane protein.
Implements protocols::moves::Mover.
References core::pose::Pose::clone(), core::pose::Pose::conformation(), protocols::membrane::create_membrane_foldtree_anchor_pose_tmcom(), core::pose::Pose::fold_tree(), core::conformation::Conformation::is_membrane(), protocols::membrane::is_membrane_fixed(), core::conformation::Conformation::membrane_info(), native_, core::pose::nres_protein(), protocols::membrane::pose_tm_com(), protocols::antibody::design::relax, core::kinematics::FoldTree::reorder(), core::pose::Pose::set_omega(), core::pose::Pose::set_phi(), core::pose::Pose::set_psi(), set_tm_helical_, sfxn_, core::kinematics::FoldTree::show(), and protocols::relax::TR().
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Rosetta Scripts Methods ///.
Create a Clone of this mover
Reimplemented from protocols::moves::Mover.
References MPRangeRelaxMover().
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Create a Fresh Instance of this Mover.
Reimplemented from protocols::moves::Mover.
References MPRangeRelaxMover().
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Mover Methods ///.
Create a new copy of this mover.
Get the name of this Mover (MPRangeRelaxMover)
Mover Methods /// Get the name of this Mover (MPRangeRelaxMover)
Implements protocols::moves::Mover.
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Init from commandline.
Set default values.
References native_, core::import_pose::PDB_file, core::import_pose::pose_from_file(), and set_tm_helical_.
Referenced by MPRangeRelaxMover().
MPRangeRelaxMover & protocols::relax::membrane::MPRangeRelaxMover::operator= | ( | MPRangeRelaxMover const & | src | ) |
Assignment Operator.
References MPRangeRelaxMover().
void protocols::relax::membrane::MPRangeRelaxMover::optimize_membrane | ( | bool | yesno | ) |
Optimize membrane.
References optmem_.
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Pase Rosetta Scripts Options for this Mover.
Reimplemented from protocols::moves::Mover.
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private |
Setup Methods ///.
Register Options from Command Line.
Register Options from Command Line
Referenced by MPRangeRelaxMover().
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Set default values.
Setup Methods ///.
Set default values
References center_resnumber_, core::scoring::ScoreFunctionFactory::create_score_function(), native_, optmem_, set_tm_helical_, and sfxn_.
Referenced by MPRangeRelaxMover().
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Center residue number.
Referenced by set_defaults().
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Native.
Referenced by apply(), init_from_cmd(), and set_defaults().
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optimize membrane?
Referenced by optimize_membrane(), and set_defaults().
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private |
Set helical secondary structure in TM region.
Referenced by apply(), init_from_cmd(), and set_defaults().
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private |
Scorefxn.
Referenced by apply(), and set_defaults().