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protocols::farna::RNA_Relaxer Class Reference

The RNA de novo structure modeling protocol. More...

#include <RNA_Relaxer.hh>

Inheritance diagram for protocols::farna::RNA_Relaxer:
Inheritance graph
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Public Member Functions

 RNA_Relaxer (RNA_FragmentMoverOP &rna_fragment_mover, RNA_MinimizerOP &rna_minimizer)
 Construct the protocol object given the RNA fragment library to use. More...
 
 ~RNA_Relaxer ()
 
void apply (core::pose::Pose &pose)
 Clone this object. More...
 
virtual std::string get_name () const
 Each derived class must specify its name. The class name. More...
 
void simple_rmsd_cutoff_relax (bool const setting)
 
- Public Member Functions inherited from protocols::moves::Mover
 Mover ()
 
virtual ~Mover ()
 
virtual MoverSP create ()
 
MoverCOP get_self_ptr () const
 
MoverOP get_self_ptr ()
 
MoverCAP get_self_weak_ptr () const
 
MoverAP get_self_weak_ptr ()
 
virtual void apply (core::io::serialization::PipeMap &pmap)
 
virtual void parse_state (SerializableState const &state)
 
virtual void parse_def (utility::lua::LuaObject const &def, utility::lua::LuaObject const &score_fxns, utility::lua::LuaObject const &tasks, MoverCacheSP cache)
 
virtual void save_state (SerializableState &state)
 
 Mover (std::string const &type_name)
 sets the type for a mover; name_ has been removed (2010/05/14) More...
 
 Mover (Mover const &other)
 
Moveroperator= (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)
 
virtual MoverOP clone () const
 Return a clone of the Mover object. More...
 
virtual void parse_my_tag (TagCOP tag, basic::datacache::DataMap &data, Filters_map const &filters, Movers_map const &movers, Pose const &pose)
 Called by MoverFactory when constructing new Movers. Takes care of the specific mover's parsing. More...
 
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 Stringsinfo ()
 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...
 
virtual MoverOP fresh_instance () const
 Generates a new Mover object freshly created with the default ctor. 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 make_fragment_moves (core::pose::Pose &pose)
 
void find_fragment_by_simple_rmsd_cutoff (core::pose::Pose &pose)
 
void lores_monte_carlo (core::pose::Pose &pose)
 

Private Attributes

RNA_FragmentMoverOP rna_fragment_mover_
 
RNA_MinimizerOP rna_minimizer_
 
Size const relax_cycles_
 
Size const max_frag_size_
 
Size const num_find_fragment_tries_
 
core::Real const rmsd_min_cutoff_
 
core::Real const rmsd_max_cutoff_
 
bool simple_rmsd_cutoff_relax_
 

Additional Inherited Members

- Public Types inherited from protocols::moves::Mover
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
 
- Static Public Member Functions inherited from protocols::moves::Mover
static std::string name ()
 
static void register_options ()
 Overload this static method if you access options within the mover. More...
 
- Protected Member Functions inherited from protocols::moves::Mover
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...
 

Detailed Description

The RNA de novo structure modeling protocol.

Constructor & Destructor Documentation

protocols::farna::RNA_Relaxer::RNA_Relaxer ( RNA_FragmentMoverOP rna_fragment_mover,
RNA_MinimizerOP rna_minimizer 
)

Construct the protocol object given the RNA fragment library to use.

protocols::farna::RNA_Relaxer::~RNA_Relaxer ( )

Member Function Documentation

void protocols::farna::RNA_Relaxer::apply ( core::pose::Pose pose)
virtual
void protocols::farna::RNA_Relaxer::find_fragment_by_simple_rmsd_cutoff ( core::pose::Pose pose)
private
std::string protocols::farna::RNA_Relaxer::get_name ( ) const
virtual

Each derived class must specify its name. The class name.

Implements protocols::moves::Mover.

void protocols::farna::RNA_Relaxer::lores_monte_carlo ( core::pose::Pose pose)
private
void protocols::farna::RNA_Relaxer::make_fragment_moves ( core::pose::Pose pose)
private
void protocols::farna::RNA_Relaxer::simple_rmsd_cutoff_relax ( bool const  setting)
inline

Member Data Documentation

Size const protocols::farna::RNA_Relaxer::max_frag_size_
private
Size const protocols::farna::RNA_Relaxer::num_find_fragment_tries_
private
Size const protocols::farna::RNA_Relaxer::relax_cycles_
private

Referenced by apply().

core::Real const protocols::farna::RNA_Relaxer::rmsd_max_cutoff_
private
core::Real const protocols::farna::RNA_Relaxer::rmsd_min_cutoff_
private
RNA_FragmentMoverOP protocols::farna::RNA_Relaxer::rna_fragment_mover_
private
RNA_MinimizerOP protocols::farna::RNA_Relaxer::rna_minimizer_
private

Referenced by apply().

bool protocols::farna::RNA_Relaxer::simple_rmsd_cutoff_relax_
private

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