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Rosetta
2021.16
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#include <SymmetricAddMembraneMover.hh>

Public Member Functions | |
| SymmetricAddMembraneMover () | |
| Constructors ///. More... | |
| SymmetricAddMembraneMover (std::string spanfile) | |
| Custom Constructor for SymmetricAddMembraneMover. More... | |
| SymmetricAddMembraneMover (core::conformation::membrane::SpanningTopologyOP topology) | |
| Custom Constructor for SymmetricAddMembraneMover. More... | |
| SymmetricAddMembraneMover (SymmetricAddMembraneMover const &src) | |
| Copy Constructor for SymmetricAddMembraneMover. More... | |
| ~SymmetricAddMembraneMover () override | |
| Destructor. More... | |
| protocols::moves::MoverOP | clone () const override |
| Rosetta Scripts Methods ///. More... | |
| protocols::moves::MoverOP | fresh_instance () const override |
| Create a Fresh Instance of this Mover. More... | |
| void | parse_my_tag (utility::tag::TagCOP tag, basic::datacache::DataMap &dm) override |
| Pase Rosetta Scripts Options for this Mover. More... | |
| core::Size | add_membrane_virtual (core::pose::Pose &pose) override |
| Mover Methods ///. More... | |
| std::string | get_name () const override |
| Mover Methods ///. More... | |
| utility::vector1< core::SSize > | check_pdb_for_mem (core::pose::Pose &pose) override |
| Helper Method - Check for Membrane residue already in the PDB. More... | |
Public Member Functions inherited from protocols::membrane::AddMembraneMover | |
| AddMembraneMover () | |
| Create a default RosettaMP membrane setup. More... | |
| AddMembraneMover (std::string spanfile, core::Size membrane_rsd=0, std::string lipid_composition="DLPC", core::Real temperature=37.0) | |
| Create a RosettaMP setup from a user specified spanfile. More... | |
| AddMembraneMover (core::Size membrane_rsd, std::string lipid_composition="DLPC", core::Real temperature=37.0) | |
| Create a RosettaMP setup from an existing membrane residue. More... | |
| AddMembraneMover (core::conformation::membrane::SpanningTopologyOP topology, core::Size anchor_rsd=1, core::Size membrane_rsd=0) | |
| Create a RosettaMP setup from a user specified SpanningTopology. More... | |
| AddMembraneMover (core::Size anchor_rsd, bool anchor_format, bool second_anchor_format, core::Size membrane_rsd=0) | |
| Create a RosettaMP setup by setting the root of the fold tree to anchor_rsd and designating MEM as membrane_rsd. The two booleans are dummy variables intended to differentiate. More... | |
| AddMembraneMover (AddMembraneMover const &src) | |
| Create a deep copy of the data in this mover. More... | |
| ~AddMembraneMover () override | |
| Destructor. More... | |
| void | apply (core::pose::Pose &pose) override |
| Initialize the RosettaMP elements with this pose. More... | |
| std::string | get_spanfile () const |
| Path to file with transmembrane span data. More... | |
| void | spanfile (std::string spanfile) |
| Set path to spanfile. More... | |
| void | restore_lazaridis_IMM1_behavior (bool restore) |
Public Member Functions inherited from protocols::moves::Mover | |
| Mover () | |
| 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 const &type_name) | |
| sets the type for a mover; name_ has been removed (2010/05/14) More... | |
| 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... | |
| 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... | |
| 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... | |
| void | set_type (std::string const &setting) |
| Set the 'type' string. More... | |
| std::string | get_type () const |
| void | type (const std::string &type_in) |
| Set the 'type' string. More... | |
| std::string const & | type () const |
| Get the set 'type' string. More... | |
| 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 |
| void | set_current_job (protocols::jobdist::BasicJobCOP job) |
| jobdist::BasicJobCOP | get_current_job () const |
| virtual void | set_current_tag (std::string const &new_tag) |
| 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 | show (std::ostream &output=std::cout) const |
| Outputs details about the Mover, including current settings. More... | |
| virtual core::Real | last_proposal_density_ratio () |
| 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 void | provide_citation_info (basic::citation_manager::CitationCollectionList &) const |
| Provide citations to the passed CitationCollectionList Subclasses should add the info for themselves and any other classes they use. More... | |
Static Public Member Functions | |
| static std::string | mover_name () |
| static void | provide_xml_schema (utility::tag::XMLSchemaDefinition &xsd) |
Static Public Member Functions inherited from protocols::membrane::AddMembraneMover | |
| static std::string | mover_name () |
| static void | provide_xml_schema (utility::tag::XMLSchemaDefinition &xsd) |
| static void | attributes_for_parse_center_normal_from_tag (utility::tag::AttributeList &attributes) |
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... | |
Private Member Functions | |
| void | register_options () |
| Setup Methods ///. More... | |
| void | init_from_cmd () |
| Initialize Mover options from the comandline. More... | |
Private Attributes | |
| utility::vector1 < core::conformation::membrane::SpanOP > | spans_from_xml_ |
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 std::list< std::string > | Strings |
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... | |
| protocols::membrane::symmetry::SymmetricAddMembraneMover::SymmetricAddMembraneMover | ( | ) |
Constructors ///.
Default constructor of SymmetricAddMembraneMover
Create a membrane pose, setting the membrane center at center=(0, 0, 0), normal=(0, 0, 1) and loads in spans and lips from the command line interface. Calls the default constructor of AddMembraneMover
References init_from_cmd(), and register_options().
| protocols::membrane::symmetry::SymmetricAddMembraneMover::SymmetricAddMembraneMover | ( | std::string | spanfile | ) |
Custom Constructor for SymmetricAddMembraneMover.
Creates a membrane pose, setting the membrane center at center=(0, 0, 0), normal=(0, 0, 1). Uses the user provided spanfile in this constructor to load the spanning topology. Calls the analagous parent constructor in AddMembraneMover
References init_from_cmd(), and register_options().
| protocols::membrane::symmetry::SymmetricAddMembraneMover::SymmetricAddMembraneMover | ( | core::conformation::membrane::SpanningTopologyOP | topology | ) |
Custom Constructor for SymmetricAddMembraneMover.
Creates a membrane pose, setting the membrane center at center=(0, 0, 0), normal=(0, 0, 1). Uses the user provided SpanningTopology to be set in MembraneInfo. Calls the analagous parent constructor in AddMembraneMover
References init_from_cmd(), and register_options().
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default |
Copy Constructor for SymmetricAddMembraneMover.
Create a deep copy of SymmetricAddMembraneMover
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overridedefault |
Destructor.
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overridevirtual |
Mover Methods ///.
Add a membrane virtual residue to the pose by inserting by jump.
Get the name of this Mover (SymmetricAddMembraneMover) Add a membrane virtual residue to the pose by inserting by jump
Adds a virtual residue to the pose by selecting the VRT_0_Base as the anchoring residue and nres_complex+1 as tne new sequence position Not equivalent to an append_by_jump!
Adds a virtual residue to the pose by selecting the VRT_0_Base as the anchoring residue and nres_complex+1 as tne new sequence position Not equivalent to an append_by_jump!
Reimplemented from protocols::membrane::AddMembraneMover.
References core::pose::Pose::conformation(), core::pose::Pose::fold_tree(), core::conformation::Conformation::insert_residue_by_jump(), core::pose::symmetry::is_symmetric(), core::kinematics::FoldTree::reorder(), core::pose::Pose::residue_type_set_for_pose(), core::pose::Pose::size(), and protocols::TR().
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overridevirtual |
Helper Method - Check for Membrane residue already in the PDB.
If there is an MEM residue in the PDB at the end of the pose with property MEMBRANE, return a vector of all of those residues.
Reimplemented from protocols::membrane::AddMembraneMover.
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overridevirtual |
Rosetta Scripts Methods ///.
Create a Clone of this mover
Reimplemented from protocols::membrane::AddMembraneMover.
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overridevirtual |
Create a Fresh Instance of this Mover.
Reimplemented from protocols::membrane::AddMembraneMover.
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overridevirtual |
Mover Methods ///.
Reimplemented from protocols::membrane::AddMembraneMover.
References mover_name().
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private |
Initialize Mover options from the comandline.
Initialize mover settings from the commandline mainly in the mp, setup group: spans_from_structure, spanfile and lipsfiles paths
References protocols::membrane::AddMembraneMover::get_spanfile(), protocols::membrane::AddMembraneMover::spanfile(), and protocols::TR().
Referenced by SymmetricAddMembraneMover().
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static |
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overridevirtual |
Pase Rosetta Scripts Options for this Mover.
Reimplemented from protocols::membrane::AddMembraneMover.
References protocols::membrane::AddMembraneMover::parse_my_tag().
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static |
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private |
Setup Methods ///.
Create a new copy of this mover.
Register Options from Command Line
Register mover-relevant options with JD2 - includes mp seutp options: spanfiles, lipsfile, and spans_from_structure.
Return the Name of this mover (as seen by Rscripts) Mover name for Rosetta Scripts Mover Methods /// Get the name of this Mover (SymmetricAddMembraneMover) Setup Methods /// Register Options from Command Line
Register mover-relevant options with JD2 - includes mp seutp options: spanfiles, lipsfile, and spans_from_structure.
Referenced by SymmetricAddMembraneMover().
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private |
1.8.7