enzymatic_movers¶
Bindings for protocols::enzymatic_movers namespace
- class pyrosetta.rosetta.protocols.enzymatic_movers.DNAMethyltransferaseMover¶
Bases:
EnzymaticMover
This Mover simulates the activity of a virtual DNA methyltransferase enzyme on a Pose by methylating a nucleic-acid residue at a biologically relevant sequon position.
- apply(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, input_pose: pyrosetta.rosetta.core.pose.Pose) None ¶
Apply the corresponding move to <input_pose>.
C++: protocols::enzymatic_movers::EnzymaticMover::apply(class core::pose::Pose &) –> void
- assign(self: pyrosetta.rosetta.protocols.enzymatic_movers.DNAMethyltransferaseMover, : pyrosetta.rosetta.protocols.enzymatic_movers.DNAMethyltransferaseMover) pyrosetta.rosetta.protocols.enzymatic_movers.DNAMethyltransferaseMover ¶
C++: protocols::enzymatic_movers::DNAMethyltransferaseMover::operator=(const class protocols::enzymatic_movers::DNAMethyltransferaseMover &) –> class protocols::enzymatic_movers::DNAMethyltransferaseMover &
- clear_info(self: pyrosetta.rosetta.protocols.moves.Mover) None ¶
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.
clear_info is called by jd2 before calling apply
C++: protocols::moves::Mover::clear_info() –> void
- clone(self: pyrosetta.rosetta.protocols.enzymatic_movers.DNAMethyltransferaseMover) pyrosetta.rosetta.protocols.moves.Mover ¶
C++: protocols::enzymatic_movers::DNAMethyltransferaseMover::clone() const –> class std::shared_ptr<class protocols::moves::Mover>
- create(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.protocols.moves.Mover ¶
C++: protocols::moves::Mover::create() –> class std::shared_ptr<class protocols::moves::Mover>
- ensure_site(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, seqpos: int) None ¶
Definitely modify this site, if it is within a consensus sequence match for this enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::ensure_site(unsigned long) –> void
- exclude_site(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, seqpos: int) None ¶
Do not perform a reaction at this site, even if it is within a consensus sequence match for this enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::exclude_site(unsigned long) –> void
- fresh_instance(self: pyrosetta.rosetta.protocols.enzymatic_movers.DNAMethyltransferaseMover) pyrosetta.rosetta.protocols.moves.Mover ¶
C++: protocols::enzymatic_movers::DNAMethyltransferaseMover::fresh_instance() const –> class std::shared_ptr<class protocols::moves::Mover>
- get_additional_output(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.core.pose.Pose ¶
fpd
Mechanism by which a mover may return multiple output poses from a single input pose.
Supported in JD2. Will attempt to grab additional poses until a nullptr is returned.
C++: protocols::moves::Mover::get_additional_output() –> class std::shared_ptr<class core::pose::Pose>
- get_co_substrate(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, index: int) str ¶
Return the requested cosubstrate of this enzymatic reaction.
C++: protocols::enzymatic_movers::EnzymaticMover::get_co_substrate(const unsigned long) const –> const std::string &
- get_current_job(self: pyrosetta.rosetta.protocols.moves.Mover) protocols::jobdist::BasicJob ¶
C++: protocols::moves::Mover::get_current_job() const –> class std::shared_ptr<const class protocols::jobdist::BasicJob>
- get_current_tag(self: pyrosetta.rosetta.protocols.moves.Mover) str ¶
- 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.
C++: protocols::moves::Mover::get_current_tag() const –> std::string
- get_efficiency(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) float ¶
Get the efficiency of this enzyme.
An efficiency of 0.45 means that this enzyme will perform its reaction at any recognized site 45% of
the time.
C++: protocols::enzymatic_movers::EnzymaticMover::get_efficiency() const –> double
- get_ensured_sites(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) pyrosetta.rosetta.utility.vector1_unsigned_long ¶
- Return a list of sequence positions that are guaranteed to be modified, if they are within a consensus
sequence match for this enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::get_ensured_sites() const –> class utility::vector1<unsigned long, class std::allocator<unsigned long> >
- get_enzyme(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) str ¶
Return the specific name of this simulated enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::get_enzyme() const –> std::string
- get_enzyme_family(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) str ¶
Get the family name of this simulated enzyme.
This EnzymaticMover is a member of this enyzme family.
C++: protocols::enzymatic_movers::EnzymaticMover::get_enzyme_family() const –> std::string
- get_excluded_sites(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) pyrosetta.rosetta.utility.vector1_unsigned_long ¶
- Return a list of sequence positions that are forbidden from being modified, even if they are within a
consensus sequence match for this enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::get_excluded_sites() const –> class utility::vector1<unsigned long, class std::allocator<unsigned long> >
- get_input_pose(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.core.pose.Pose ¶
C++: protocols::moves::Mover::get_input_pose() const –> class std::shared_ptr<const class core::pose::Pose>
- get_last_move_status(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.protocols.moves.MoverStatus ¶
returns status after an apply(). The job distributor (august 08 vintage) will check this function to see if your protocol wants to filter its results - if your protocol wants to say “that run was no good, skip it” then use the protected last_move_status(MoverStatus) to change the value that this function will return.
C++: protocols::moves::Mover::get_last_move_status() const –> enum protocols::moves::MoverStatus
- get_n_co_substrates(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) int ¶
Return the current number of reactive sites.
C++: protocols::enzymatic_movers::EnzymaticMover::get_n_co_substrates() const –> unsigned long
- get_n_reactive_sites(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) int ¶
Return the current number of reactive sites.
C++: protocols::enzymatic_movers::EnzymaticMover::get_n_reactive_sites() const –> unsigned long
- get_name(self: pyrosetta.rosetta.protocols.enzymatic_movers.DNAMethyltransferaseMover) str ¶
Return the name of the Mover.
C++: protocols::enzymatic_movers::DNAMethyltransferaseMover::get_name() const –> std::string
- get_native_pose(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.core.pose.Pose ¶
C++: protocols::moves::Mover::get_native_pose() const –> class std::shared_ptr<const class core::pose::Pose>
- get_reactive_site_atom_name(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, index: int) str ¶
Return the atom name of the requested reactive site.
C++: protocols::enzymatic_movers::EnzymaticMover::get_reactive_site_atom_name(const unsigned long) const –> const std::string &
- get_reactive_site_sequence_position(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, index: int) int ¶
Return the sequence position of the requested reactive site.
C++: protocols::enzymatic_movers::EnzymaticMover::get_reactive_site_sequence_position(const unsigned long) const –> unsigned long
- get_self_ptr(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.protocols.moves.Mover ¶
C++: protocols::moves::Mover::get_self_ptr() –> class std::shared_ptr<class protocols::moves::Mover>
- get_self_weak_ptr(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.std.weak_ptr_protocols_moves_Mover_t ¶
C++: protocols::moves::Mover::get_self_weak_ptr() –> class std::weak_ptr<class protocols::moves::Mover>
- get_species(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) str ¶
Get the species name of this simulated enzyme.
This EnzymaticMover is limited to reactions known to occur in the returned species.
C++: protocols::enzymatic_movers::EnzymaticMover::get_species() const –> std::string
- get_type(self: pyrosetta.rosetta.protocols.moves.Mover) str ¶
C++: protocols::moves::Mover::get_type() const –> std::string
- info(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.std.list_std_string_t ¶
non-const accessor
C++: protocols::moves::Mover::info() –> class std::list<std::string, class std::allocator<std::string > > &
- last_proposal_density_ratio(self: pyrosetta.rosetta.protocols.moves.Mover) float ¶
C++: protocols::moves::Mover::last_proposal_density_ratio() –> double
- static mover_name() str ¶
C++: protocols::enzymatic_movers::DNAMethyltransferaseMover::mover_name() –> std::string
- static name() str ¶
C++: protocols::moves::Mover::name() –> std::string
- parse_my_tag(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, tag: pyrosetta.rosetta.utility.tag.Tag, data: pyrosetta.rosetta.basic.datacache.DataMap) None ¶
C++: protocols::enzymatic_movers::EnzymaticMover::parse_my_tag(class std::shared_ptr<const class utility::tag::Tag>, class basic::datacache::DataMap &) –> void
- perform_all_reactions(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) None ¶
- Allow this EnzymaticMover to be promiscuous, performing a random transfer from among its possible
co-substrates.
C++: protocols::enzymatic_movers::EnzymaticMover::perform_all_reactions() –> void
- perform_major_reaction_only(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) None ¶
Set this EnzymaticMover to perform only its major reaction.
C++: protocols::enzymatic_movers::EnzymaticMover::perform_major_reaction_only() –> void
- performs_major_reaction_only(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) bool ¶
Does this enzyme only perform its major reaction?
C++: protocols::enzymatic_movers::EnzymaticMover::performs_major_reaction_only() const –> bool
- provide_citation_info(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, : pyrosetta.rosetta.basic.citation_manager.CitationCollectionList) None ¶
Provide the citation.
C++: protocols::enzymatic_movers::EnzymaticMover::provide_citation_info(class basic::citation_manager::CitationCollectionList &) const –> void
- static provide_xml_schema(xsd: utility::tag::XMLSchemaDefinition) None ¶
C++: protocols::enzymatic_movers::DNAMethyltransferaseMover::provide_xml_schema(class utility::tag::XMLSchemaDefinition &) –> void
- static register_options() None ¶
Register options with the option system.
C++: protocols::enzymatic_movers::DNAMethyltransferaseMover::register_options() –> void
- reinitialize_for_each_job(self: pyrosetta.rosetta.protocols.moves.Mover) bool ¶
- Inform the Job Distributor (August ‘08 vintage) whether this object needs to be freshly regenerated on
each use.
C++: protocols::moves::Mover::reinitialize_for_each_job() const –> bool
- reinitialize_for_new_input(self: pyrosetta.rosetta.protocols.moves.Mover) bool ¶
- 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).
C++: protocols::moves::Mover::reinitialize_for_new_input() const –> bool
- reset_status(self: pyrosetta.rosetta.protocols.moves.Mover) None ¶
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.
C++: protocols::moves::Mover::reset_status() –> void
- set_current_job(self: pyrosetta.rosetta.protocols.moves.Mover, job: protocols::jobdist::BasicJob) None ¶
C++: protocols::moves::Mover::set_current_job(class std::shared_ptr<const class protocols::jobdist::BasicJob>) –> void
- set_current_tag(self: pyrosetta.rosetta.protocols.moves.Mover, new_tag: str) None ¶
C++: protocols::moves::Mover::set_current_tag(const std::string &) –> void
- set_efficiency(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, setting: float) None ¶
Directly set the efficiency of this enzyme, ignoring whatever is in the database.
An efficiency of 0.45 means that this enzyme will perform its reaction at any recognized site 45% of
the time.
C++: protocols::enzymatic_movers::EnzymaticMover::set_efficiency(double) –> void
- set_ensured_sites(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, ensured_sites: pyrosetta.rosetta.utility.vector1_unsigned_long) None ¶
- Pass a list of sequence positions that are guaranteed to be modified, if they are within a consensus
sequence match for this enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::set_ensured_sites(const class utility::vector1<unsigned long, class std::allocator<unsigned long> > &) –> void
- set_enzyme(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, enzyme_name: str) None ¶
Set the specific name of this simulated enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::set_enzyme(const std::string &) –> void
- set_excluded_sites(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, excluded_sites: pyrosetta.rosetta.utility.vector1_unsigned_long) None ¶
- Pass a list of sequence positions that are forbidden from being modified, even if they are within a
consensus sequence match for this enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::set_excluded_sites(const class utility::vector1<unsigned long, class std::allocator<unsigned long> > &) –> void
- set_input_pose(self: pyrosetta.rosetta.protocols.moves.Mover, pose: pyrosetta.rosetta.core.pose.Pose) None ¶
setter for poses contained for rms
C++: protocols::moves::Mover::set_input_pose(class std::shared_ptr<const class core::pose::Pose>) –> void
- set_native_pose(self: pyrosetta.rosetta.protocols.moves.Mover, pose: pyrosetta.rosetta.core.pose.Pose) None ¶
setter for native poses contained for rms —- we should get rid of this method? it is widely used, but a bit unsafe
C++: protocols::moves::Mover::set_native_pose(class std::shared_ptr<const class core::pose::Pose>) –> void
- set_pose_reactive_sites(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, pose: pyrosetta.rosetta.core.pose.Pose) None ¶
C++: protocols::enzymatic_movers::EnzymaticMover::set_pose_reactive_sites(const class core::pose::Pose &) –> void
- set_species(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, species_name: str) None ¶
Set the species name of this simulated enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::set_species(const std::string &) –> void
- set_type(self: pyrosetta.rosetta.protocols.moves.Mover, setting: str) None ¶
Set the ‘type’ string
C++: protocols::moves::Mover::set_type(const std::string &) –> void
- show(*args, **kwargs)¶
Overloaded function.
show(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) -> None
show(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, output: pyrosetta.rosetta.std.ostream) -> None
Generate string representation of EnzymaticMover for debugging purposes.
C++: protocols::enzymatic_movers::EnzymaticMover::show(std::ostream &) const –> void
- test_move(self: pyrosetta.rosetta.protocols.moves.Mover, pose: pyrosetta.rosetta.core.pose.Pose) None ¶
- : Unit test support function. Apply one move to a given pose.
Allows extra test specific functions to be called before applying
C++: protocols::moves::Mover::test_move(class core::pose::Pose &) –> void
- type(*args, **kwargs)¶
Overloaded function.
type(self: pyrosetta.rosetta.protocols.moves.Mover, type_in: str) -> None
Set the ‘type’ string
C++: protocols::moves::Mover::type(const std::string &) –> void
type(self: pyrosetta.rosetta.protocols.moves.Mover) -> str
Get the set ‘type’ string
C++: protocols::moves::Mover::type() const –> const std::string &
- static xml_schema_complex_type_generator() utility::tag::XMLSchemaComplexTypeGenerator ¶
C++: protocols::enzymatic_movers::EnzymaticMover::xml_schema_complex_type_generator() –> class std::shared_ptr<class utility::tag::XMLSchemaComplexTypeGenerator>
- class pyrosetta.rosetta.protocols.enzymatic_movers.DNAMethyltransferaseMoverCreator¶
Bases:
MoverCreator
MoverCreator allowing the MoverFactory to create a DNAMethyltransferaseMover.
- assign(self: pyrosetta.rosetta.protocols.enzymatic_movers.DNAMethyltransferaseMoverCreator, : pyrosetta.rosetta.protocols.enzymatic_movers.DNAMethyltransferaseMoverCreator) pyrosetta.rosetta.protocols.enzymatic_movers.DNAMethyltransferaseMoverCreator ¶
C++: protocols::enzymatic_movers::DNAMethyltransferaseMoverCreator::operator=(const class protocols::enzymatic_movers::DNAMethyltransferaseMoverCreator &) –> class protocols::enzymatic_movers::DNAMethyltransferaseMoverCreator &
- create_mover(self: pyrosetta.rosetta.protocols.enzymatic_movers.DNAMethyltransferaseMoverCreator) pyrosetta.rosetta.protocols.moves.Mover ¶
Return an up-casted owning pointer (MoverOP) to the mover.
C++: protocols::enzymatic_movers::DNAMethyltransferaseMoverCreator::create_mover() const –> class std::shared_ptr<class protocols::moves::Mover>
- keyname(self: pyrosetta.rosetta.protocols.enzymatic_movers.DNAMethyltransferaseMoverCreator) str ¶
Return the key name for the associated Mover (DNAMethyltransferaseMover).
C++: protocols::enzymatic_movers::DNAMethyltransferaseMoverCreator::keyname() const –> std::string
- class pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover¶
Bases:
Mover
This is a base class for any Mover that modifies the sequence of a Pose in a way that simulates the action of an enzyme. Any Mover inheriting from this base class must provide an enzyme family corresponding to a directory of enzyme data and must implement the perform_reaction() method, which modifies, adds, or removes (a) Residue(s). The core machinery of this base class uses the enzymatic data to search for potential reaction sites.
- apply(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, input_pose: pyrosetta.rosetta.core.pose.Pose) None ¶
Apply the corresponding move to <input_pose>.
C++: protocols::enzymatic_movers::EnzymaticMover::apply(class core::pose::Pose &) –> void
- assign(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, : pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover ¶
C++: protocols::enzymatic_movers::EnzymaticMover::operator=(const class protocols::enzymatic_movers::EnzymaticMover &) –> class protocols::enzymatic_movers::EnzymaticMover &
- clear_info(self: pyrosetta.rosetta.protocols.moves.Mover) None ¶
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.
clear_info is called by jd2 before calling apply
C++: protocols::moves::Mover::clear_info() –> void
- clone(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) pyrosetta.rosetta.protocols.moves.Mover ¶
C++: protocols::enzymatic_movers::EnzymaticMover::clone() const –> class std::shared_ptr<class protocols::moves::Mover>
- create(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.protocols.moves.Mover ¶
C++: protocols::moves::Mover::create() –> class std::shared_ptr<class protocols::moves::Mover>
- ensure_site(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, seqpos: int) None ¶
Definitely modify this site, if it is within a consensus sequence match for this enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::ensure_site(unsigned long) –> void
- exclude_site(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, seqpos: int) None ¶
Do not perform a reaction at this site, even if it is within a consensus sequence match for this enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::exclude_site(unsigned long) –> void
- fresh_instance(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) pyrosetta.rosetta.protocols.moves.Mover ¶
C++: protocols::enzymatic_movers::EnzymaticMover::fresh_instance() const –> class std::shared_ptr<class protocols::moves::Mover>
- get_additional_output(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.core.pose.Pose ¶
fpd
Mechanism by which a mover may return multiple output poses from a single input pose.
Supported in JD2. Will attempt to grab additional poses until a nullptr is returned.
C++: protocols::moves::Mover::get_additional_output() –> class std::shared_ptr<class core::pose::Pose>
- get_co_substrate(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, index: int) str ¶
Return the requested cosubstrate of this enzymatic reaction.
C++: protocols::enzymatic_movers::EnzymaticMover::get_co_substrate(const unsigned long) const –> const std::string &
- get_current_job(self: pyrosetta.rosetta.protocols.moves.Mover) protocols::jobdist::BasicJob ¶
C++: protocols::moves::Mover::get_current_job() const –> class std::shared_ptr<const class protocols::jobdist::BasicJob>
- get_current_tag(self: pyrosetta.rosetta.protocols.moves.Mover) str ¶
- 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.
C++: protocols::moves::Mover::get_current_tag() const –> std::string
- get_efficiency(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) float ¶
Get the efficiency of this enzyme.
An efficiency of 0.45 means that this enzyme will perform its reaction at any recognized site 45% of
the time.
C++: protocols::enzymatic_movers::EnzymaticMover::get_efficiency() const –> double
- get_ensured_sites(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) pyrosetta.rosetta.utility.vector1_unsigned_long ¶
- Return a list of sequence positions that are guaranteed to be modified, if they are within a consensus
sequence match for this enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::get_ensured_sites() const –> class utility::vector1<unsigned long, class std::allocator<unsigned long> >
- get_enzyme(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) str ¶
Return the specific name of this simulated enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::get_enzyme() const –> std::string
- get_enzyme_family(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) str ¶
Get the family name of this simulated enzyme.
This EnzymaticMover is a member of this enyzme family.
C++: protocols::enzymatic_movers::EnzymaticMover::get_enzyme_family() const –> std::string
- get_excluded_sites(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) pyrosetta.rosetta.utility.vector1_unsigned_long ¶
- Return a list of sequence positions that are forbidden from being modified, even if they are within a
consensus sequence match for this enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::get_excluded_sites() const –> class utility::vector1<unsigned long, class std::allocator<unsigned long> >
- get_input_pose(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.core.pose.Pose ¶
C++: protocols::moves::Mover::get_input_pose() const –> class std::shared_ptr<const class core::pose::Pose>
- get_last_move_status(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.protocols.moves.MoverStatus ¶
returns status after an apply(). The job distributor (august 08 vintage) will check this function to see if your protocol wants to filter its results - if your protocol wants to say “that run was no good, skip it” then use the protected last_move_status(MoverStatus) to change the value that this function will return.
C++: protocols::moves::Mover::get_last_move_status() const –> enum protocols::moves::MoverStatus
- get_n_co_substrates(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) int ¶
Return the current number of reactive sites.
C++: protocols::enzymatic_movers::EnzymaticMover::get_n_co_substrates() const –> unsigned long
- get_n_reactive_sites(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) int ¶
Return the current number of reactive sites.
C++: protocols::enzymatic_movers::EnzymaticMover::get_n_reactive_sites() const –> unsigned long
- get_name(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) str ¶
Return the name of the Mover.
C++: protocols::enzymatic_movers::EnzymaticMover::get_name() const –> std::string
- get_native_pose(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.core.pose.Pose ¶
C++: protocols::moves::Mover::get_native_pose() const –> class std::shared_ptr<const class core::pose::Pose>
- get_reactive_site_atom_name(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, index: int) str ¶
Return the atom name of the requested reactive site.
C++: protocols::enzymatic_movers::EnzymaticMover::get_reactive_site_atom_name(const unsigned long) const –> const std::string &
- get_reactive_site_sequence_position(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, index: int) int ¶
Return the sequence position of the requested reactive site.
C++: protocols::enzymatic_movers::EnzymaticMover::get_reactive_site_sequence_position(const unsigned long) const –> unsigned long
- get_self_ptr(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.protocols.moves.Mover ¶
C++: protocols::moves::Mover::get_self_ptr() –> class std::shared_ptr<class protocols::moves::Mover>
- get_self_weak_ptr(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.std.weak_ptr_protocols_moves_Mover_t ¶
C++: protocols::moves::Mover::get_self_weak_ptr() –> class std::weak_ptr<class protocols::moves::Mover>
- get_species(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) str ¶
Get the species name of this simulated enzyme.
This EnzymaticMover is limited to reactions known to occur in the returned species.
C++: protocols::enzymatic_movers::EnzymaticMover::get_species() const –> std::string
- get_type(self: pyrosetta.rosetta.protocols.moves.Mover) str ¶
C++: protocols::moves::Mover::get_type() const –> std::string
- info(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.std.list_std_string_t ¶
non-const accessor
C++: protocols::moves::Mover::info() –> class std::list<std::string, class std::allocator<std::string > > &
- last_proposal_density_ratio(self: pyrosetta.rosetta.protocols.moves.Mover) float ¶
C++: protocols::moves::Mover::last_proposal_density_ratio() –> double
- static name() str ¶
C++: protocols::moves::Mover::name() –> std::string
- parse_my_tag(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, tag: pyrosetta.rosetta.utility.tag.Tag, data: pyrosetta.rosetta.basic.datacache.DataMap) None ¶
C++: protocols::enzymatic_movers::EnzymaticMover::parse_my_tag(class std::shared_ptr<const class utility::tag::Tag>, class basic::datacache::DataMap &) –> void
- perform_all_reactions(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) None ¶
- Allow this EnzymaticMover to be promiscuous, performing a random transfer from among its possible
co-substrates.
C++: protocols::enzymatic_movers::EnzymaticMover::perform_all_reactions() –> void
- perform_major_reaction_only(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) None ¶
Set this EnzymaticMover to perform only its major reaction.
C++: protocols::enzymatic_movers::EnzymaticMover::perform_major_reaction_only() –> void
- performs_major_reaction_only(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) bool ¶
Does this enzyme only perform its major reaction?
C++: protocols::enzymatic_movers::EnzymaticMover::performs_major_reaction_only() const –> bool
- provide_citation_info(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, : pyrosetta.rosetta.basic.citation_manager.CitationCollectionList) None ¶
Provide the citation.
C++: protocols::enzymatic_movers::EnzymaticMover::provide_citation_info(class basic::citation_manager::CitationCollectionList &) const –> void
- static register_options() None ¶
Register options with the option system.
C++: protocols::enzymatic_movers::EnzymaticMover::register_options() –> void
- reinitialize_for_each_job(self: pyrosetta.rosetta.protocols.moves.Mover) bool ¶
- Inform the Job Distributor (August ‘08 vintage) whether this object needs to be freshly regenerated on
each use.
C++: protocols::moves::Mover::reinitialize_for_each_job() const –> bool
- reinitialize_for_new_input(self: pyrosetta.rosetta.protocols.moves.Mover) bool ¶
- 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).
C++: protocols::moves::Mover::reinitialize_for_new_input() const –> bool
- reset_status(self: pyrosetta.rosetta.protocols.moves.Mover) None ¶
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.
C++: protocols::moves::Mover::reset_status() –> void
- set_current_job(self: pyrosetta.rosetta.protocols.moves.Mover, job: protocols::jobdist::BasicJob) None ¶
C++: protocols::moves::Mover::set_current_job(class std::shared_ptr<const class protocols::jobdist::BasicJob>) –> void
- set_current_tag(self: pyrosetta.rosetta.protocols.moves.Mover, new_tag: str) None ¶
C++: protocols::moves::Mover::set_current_tag(const std::string &) –> void
- set_efficiency(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, setting: float) None ¶
Directly set the efficiency of this enzyme, ignoring whatever is in the database.
An efficiency of 0.45 means that this enzyme will perform its reaction at any recognized site 45% of
the time.
C++: protocols::enzymatic_movers::EnzymaticMover::set_efficiency(double) –> void
- set_ensured_sites(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, ensured_sites: pyrosetta.rosetta.utility.vector1_unsigned_long) None ¶
- Pass a list of sequence positions that are guaranteed to be modified, if they are within a consensus
sequence match for this enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::set_ensured_sites(const class utility::vector1<unsigned long, class std::allocator<unsigned long> > &) –> void
- set_enzyme(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, enzyme_name: str) None ¶
Set the specific name of this simulated enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::set_enzyme(const std::string &) –> void
- set_excluded_sites(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, excluded_sites: pyrosetta.rosetta.utility.vector1_unsigned_long) None ¶
- Pass a list of sequence positions that are forbidden from being modified, even if they are within a
consensus sequence match for this enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::set_excluded_sites(const class utility::vector1<unsigned long, class std::allocator<unsigned long> > &) –> void
- set_input_pose(self: pyrosetta.rosetta.protocols.moves.Mover, pose: pyrosetta.rosetta.core.pose.Pose) None ¶
setter for poses contained for rms
C++: protocols::moves::Mover::set_input_pose(class std::shared_ptr<const class core::pose::Pose>) –> void
- set_native_pose(self: pyrosetta.rosetta.protocols.moves.Mover, pose: pyrosetta.rosetta.core.pose.Pose) None ¶
setter for native poses contained for rms —- we should get rid of this method? it is widely used, but a bit unsafe
C++: protocols::moves::Mover::set_native_pose(class std::shared_ptr<const class core::pose::Pose>) –> void
- set_pose_reactive_sites(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, pose: pyrosetta.rosetta.core.pose.Pose) None ¶
C++: protocols::enzymatic_movers::EnzymaticMover::set_pose_reactive_sites(const class core::pose::Pose &) –> void
- set_species(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, species_name: str) None ¶
Set the species name of this simulated enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::set_species(const std::string &) –> void
- set_type(self: pyrosetta.rosetta.protocols.moves.Mover, setting: str) None ¶
Set the ‘type’ string
C++: protocols::moves::Mover::set_type(const std::string &) –> void
- show(*args, **kwargs)¶
Overloaded function.
show(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) -> None
show(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, output: pyrosetta.rosetta.std.ostream) -> None
Generate string representation of EnzymaticMover for debugging purposes.
C++: protocols::enzymatic_movers::EnzymaticMover::show(std::ostream &) const –> void
- test_move(self: pyrosetta.rosetta.protocols.moves.Mover, pose: pyrosetta.rosetta.core.pose.Pose) None ¶
- : Unit test support function. Apply one move to a given pose.
Allows extra test specific functions to be called before applying
C++: protocols::moves::Mover::test_move(class core::pose::Pose &) –> void
- type(*args, **kwargs)¶
Overloaded function.
type(self: pyrosetta.rosetta.protocols.moves.Mover, type_in: str) -> None
Set the ‘type’ string
C++: protocols::moves::Mover::type(const std::string &) –> void
type(self: pyrosetta.rosetta.protocols.moves.Mover) -> str
Get the set ‘type’ string
C++: protocols::moves::Mover::type() const –> const std::string &
- static xml_schema_complex_type_generator() utility::tag::XMLSchemaComplexTypeGenerator ¶
C++: protocols::enzymatic_movers::EnzymaticMover::xml_schema_complex_type_generator() –> class std::shared_ptr<class utility::tag::XMLSchemaComplexTypeGenerator>
- class pyrosetta.rosetta.protocols.enzymatic_movers.GlycosyltransferaseMover¶
Bases:
EnzymaticMover
This Mover simulates the activity of a virtual glycosyltransferase enzyme on a Pose by glycosylating a residue at a biologically relevant sequon position.
- apply(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, input_pose: pyrosetta.rosetta.core.pose.Pose) None ¶
Apply the corresponding move to <input_pose>.
C++: protocols::enzymatic_movers::EnzymaticMover::apply(class core::pose::Pose &) –> void
- assign(self: pyrosetta.rosetta.protocols.enzymatic_movers.GlycosyltransferaseMover, : pyrosetta.rosetta.protocols.enzymatic_movers.GlycosyltransferaseMover) pyrosetta.rosetta.protocols.enzymatic_movers.GlycosyltransferaseMover ¶
C++: protocols::enzymatic_movers::GlycosyltransferaseMover::operator=(const class protocols::enzymatic_movers::GlycosyltransferaseMover &) –> class protocols::enzymatic_movers::GlycosyltransferaseMover &
- clear_info(self: pyrosetta.rosetta.protocols.moves.Mover) None ¶
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.
clear_info is called by jd2 before calling apply
C++: protocols::moves::Mover::clear_info() –> void
- clone(self: pyrosetta.rosetta.protocols.enzymatic_movers.GlycosyltransferaseMover) pyrosetta.rosetta.protocols.moves.Mover ¶
C++: protocols::enzymatic_movers::GlycosyltransferaseMover::clone() const –> class std::shared_ptr<class protocols::moves::Mover>
- create(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.protocols.moves.Mover ¶
C++: protocols::moves::Mover::create() –> class std::shared_ptr<class protocols::moves::Mover>
- ensure_site(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, seqpos: int) None ¶
Definitely modify this site, if it is within a consensus sequence match for this enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::ensure_site(unsigned long) –> void
- exclude_site(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, seqpos: int) None ¶
Do not perform a reaction at this site, even if it is within a consensus sequence match for this enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::exclude_site(unsigned long) –> void
- fresh_instance(self: pyrosetta.rosetta.protocols.enzymatic_movers.GlycosyltransferaseMover) pyrosetta.rosetta.protocols.moves.Mover ¶
C++: protocols::enzymatic_movers::GlycosyltransferaseMover::fresh_instance() const –> class std::shared_ptr<class protocols::moves::Mover>
- get_additional_output(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.core.pose.Pose ¶
fpd
Mechanism by which a mover may return multiple output poses from a single input pose.
Supported in JD2. Will attempt to grab additional poses until a nullptr is returned.
C++: protocols::moves::Mover::get_additional_output() –> class std::shared_ptr<class core::pose::Pose>
- get_co_substrate(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, index: int) str ¶
Return the requested cosubstrate of this enzymatic reaction.
C++: protocols::enzymatic_movers::EnzymaticMover::get_co_substrate(const unsigned long) const –> const std::string &
- get_current_job(self: pyrosetta.rosetta.protocols.moves.Mover) protocols::jobdist::BasicJob ¶
C++: protocols::moves::Mover::get_current_job() const –> class std::shared_ptr<const class protocols::jobdist::BasicJob>
- get_current_tag(self: pyrosetta.rosetta.protocols.moves.Mover) str ¶
- 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.
C++: protocols::moves::Mover::get_current_tag() const –> std::string
- get_efficiency(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) float ¶
Get the efficiency of this enzyme.
An efficiency of 0.45 means that this enzyme will perform its reaction at any recognized site 45% of
the time.
C++: protocols::enzymatic_movers::EnzymaticMover::get_efficiency() const –> double
- get_ensured_sites(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) pyrosetta.rosetta.utility.vector1_unsigned_long ¶
- Return a list of sequence positions that are guaranteed to be modified, if they are within a consensus
sequence match for this enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::get_ensured_sites() const –> class utility::vector1<unsigned long, class std::allocator<unsigned long> >
- get_enzyme(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) str ¶
Return the specific name of this simulated enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::get_enzyme() const –> std::string
- get_enzyme_family(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) str ¶
Get the family name of this simulated enzyme.
This EnzymaticMover is a member of this enyzme family.
C++: protocols::enzymatic_movers::EnzymaticMover::get_enzyme_family() const –> std::string
- get_excluded_sites(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) pyrosetta.rosetta.utility.vector1_unsigned_long ¶
- Return a list of sequence positions that are forbidden from being modified, even if they are within a
consensus sequence match for this enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::get_excluded_sites() const –> class utility::vector1<unsigned long, class std::allocator<unsigned long> >
- get_input_pose(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.core.pose.Pose ¶
C++: protocols::moves::Mover::get_input_pose() const –> class std::shared_ptr<const class core::pose::Pose>
- get_last_move_status(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.protocols.moves.MoverStatus ¶
returns status after an apply(). The job distributor (august 08 vintage) will check this function to see if your protocol wants to filter its results - if your protocol wants to say “that run was no good, skip it” then use the protected last_move_status(MoverStatus) to change the value that this function will return.
C++: protocols::moves::Mover::get_last_move_status() const –> enum protocols::moves::MoverStatus
- get_n_co_substrates(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) int ¶
Return the current number of reactive sites.
C++: protocols::enzymatic_movers::EnzymaticMover::get_n_co_substrates() const –> unsigned long
- get_n_reactive_sites(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) int ¶
Return the current number of reactive sites.
C++: protocols::enzymatic_movers::EnzymaticMover::get_n_reactive_sites() const –> unsigned long
- get_name(self: pyrosetta.rosetta.protocols.enzymatic_movers.GlycosyltransferaseMover) str ¶
Return the name of the Mover.
C++: protocols::enzymatic_movers::GlycosyltransferaseMover::get_name() const –> std::string
- get_native_pose(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.core.pose.Pose ¶
C++: protocols::moves::Mover::get_native_pose() const –> class std::shared_ptr<const class core::pose::Pose>
- get_reactive_site_atom_name(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, index: int) str ¶
Return the atom name of the requested reactive site.
C++: protocols::enzymatic_movers::EnzymaticMover::get_reactive_site_atom_name(const unsigned long) const –> const std::string &
- get_reactive_site_sequence_position(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, index: int) int ¶
Return the sequence position of the requested reactive site.
C++: protocols::enzymatic_movers::EnzymaticMover::get_reactive_site_sequence_position(const unsigned long) const –> unsigned long
- get_self_ptr(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.protocols.moves.Mover ¶
C++: protocols::moves::Mover::get_self_ptr() –> class std::shared_ptr<class protocols::moves::Mover>
- get_self_weak_ptr(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.std.weak_ptr_protocols_moves_Mover_t ¶
C++: protocols::moves::Mover::get_self_weak_ptr() –> class std::weak_ptr<class protocols::moves::Mover>
- get_species(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) str ¶
Get the species name of this simulated enzyme.
This EnzymaticMover is limited to reactions known to occur in the returned species.
C++: protocols::enzymatic_movers::EnzymaticMover::get_species() const –> std::string
- get_type(self: pyrosetta.rosetta.protocols.moves.Mover) str ¶
C++: protocols::moves::Mover::get_type() const –> std::string
- info(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.std.list_std_string_t ¶
non-const accessor
C++: protocols::moves::Mover::info() –> class std::list<std::string, class std::allocator<std::string > > &
- last_proposal_density_ratio(self: pyrosetta.rosetta.protocols.moves.Mover) float ¶
C++: protocols::moves::Mover::last_proposal_density_ratio() –> double
- static mover_name() str ¶
C++: protocols::enzymatic_movers::GlycosyltransferaseMover::mover_name() –> std::string
- static name() str ¶
C++: protocols::moves::Mover::name() –> std::string
- parse_my_tag(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, tag: pyrosetta.rosetta.utility.tag.Tag, data: pyrosetta.rosetta.basic.datacache.DataMap) None ¶
C++: protocols::enzymatic_movers::EnzymaticMover::parse_my_tag(class std::shared_ptr<const class utility::tag::Tag>, class basic::datacache::DataMap &) –> void
- perform_all_reactions(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) None ¶
- Allow this EnzymaticMover to be promiscuous, performing a random transfer from among its possible
co-substrates.
C++: protocols::enzymatic_movers::EnzymaticMover::perform_all_reactions() –> void
- perform_major_reaction_only(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) None ¶
Set this EnzymaticMover to perform only its major reaction.
C++: protocols::enzymatic_movers::EnzymaticMover::perform_major_reaction_only() –> void
- performs_major_reaction_only(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) bool ¶
Does this enzyme only perform its major reaction?
C++: protocols::enzymatic_movers::EnzymaticMover::performs_major_reaction_only() const –> bool
- provide_citation_info(self: pyrosetta.rosetta.protocols.enzymatic_movers.GlycosyltransferaseMover, : pyrosetta.rosetta.basic.citation_manager.CitationCollectionList) None ¶
Provide the citation.
C++: protocols::enzymatic_movers::GlycosyltransferaseMover::provide_citation_info(class basic::citation_manager::CitationCollectionList &) const –> void
- static provide_xml_schema(xsd: utility::tag::XMLSchemaDefinition) None ¶
C++: protocols::enzymatic_movers::GlycosyltransferaseMover::provide_xml_schema(class utility::tag::XMLSchemaDefinition &) –> void
- static register_options() None ¶
Register options with the option system.
C++: protocols::enzymatic_movers::GlycosyltransferaseMover::register_options() –> void
- reinitialize_for_each_job(self: pyrosetta.rosetta.protocols.moves.Mover) bool ¶
- Inform the Job Distributor (August ‘08 vintage) whether this object needs to be freshly regenerated on
each use.
C++: protocols::moves::Mover::reinitialize_for_each_job() const –> bool
- reinitialize_for_new_input(self: pyrosetta.rosetta.protocols.moves.Mover) bool ¶
- 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).
C++: protocols::moves::Mover::reinitialize_for_new_input() const –> bool
- reset_status(self: pyrosetta.rosetta.protocols.moves.Mover) None ¶
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.
C++: protocols::moves::Mover::reset_status() –> void
- set_current_job(self: pyrosetta.rosetta.protocols.moves.Mover, job: protocols::jobdist::BasicJob) None ¶
C++: protocols::moves::Mover::set_current_job(class std::shared_ptr<const class protocols::jobdist::BasicJob>) –> void
- set_current_tag(self: pyrosetta.rosetta.protocols.moves.Mover, new_tag: str) None ¶
C++: protocols::moves::Mover::set_current_tag(const std::string &) –> void
- set_efficiency(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, setting: float) None ¶
Directly set the efficiency of this enzyme, ignoring whatever is in the database.
An efficiency of 0.45 means that this enzyme will perform its reaction at any recognized site 45% of
the time.
C++: protocols::enzymatic_movers::EnzymaticMover::set_efficiency(double) –> void
- set_ensured_sites(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, ensured_sites: pyrosetta.rosetta.utility.vector1_unsigned_long) None ¶
- Pass a list of sequence positions that are guaranteed to be modified, if they are within a consensus
sequence match for this enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::set_ensured_sites(const class utility::vector1<unsigned long, class std::allocator<unsigned long> > &) –> void
- set_enzyme(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, enzyme_name: str) None ¶
Set the specific name of this simulated enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::set_enzyme(const std::string &) –> void
- set_excluded_sites(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, excluded_sites: pyrosetta.rosetta.utility.vector1_unsigned_long) None ¶
- Pass a list of sequence positions that are forbidden from being modified, even if they are within a
consensus sequence match for this enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::set_excluded_sites(const class utility::vector1<unsigned long, class std::allocator<unsigned long> > &) –> void
- set_input_pose(self: pyrosetta.rosetta.protocols.moves.Mover, pose: pyrosetta.rosetta.core.pose.Pose) None ¶
setter for poses contained for rms
C++: protocols::moves::Mover::set_input_pose(class std::shared_ptr<const class core::pose::Pose>) –> void
- set_native_pose(self: pyrosetta.rosetta.protocols.moves.Mover, pose: pyrosetta.rosetta.core.pose.Pose) None ¶
setter for native poses contained for rms —- we should get rid of this method? it is widely used, but a bit unsafe
C++: protocols::moves::Mover::set_native_pose(class std::shared_ptr<const class core::pose::Pose>) –> void
- set_pose_reactive_sites(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, pose: pyrosetta.rosetta.core.pose.Pose) None ¶
C++: protocols::enzymatic_movers::EnzymaticMover::set_pose_reactive_sites(const class core::pose::Pose &) –> void
- set_species(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, species_name: str) None ¶
Set the species name of this simulated enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::set_species(const std::string &) –> void
- set_type(self: pyrosetta.rosetta.protocols.moves.Mover, setting: str) None ¶
Set the ‘type’ string
C++: protocols::moves::Mover::set_type(const std::string &) –> void
- show(*args, **kwargs)¶
Overloaded function.
show(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) -> None
show(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, output: pyrosetta.rosetta.std.ostream) -> None
Generate string representation of EnzymaticMover for debugging purposes.
C++: protocols::enzymatic_movers::EnzymaticMover::show(std::ostream &) const –> void
- test_move(self: pyrosetta.rosetta.protocols.moves.Mover, pose: pyrosetta.rosetta.core.pose.Pose) None ¶
- : Unit test support function. Apply one move to a given pose.
Allows extra test specific functions to be called before applying
C++: protocols::moves::Mover::test_move(class core::pose::Pose &) –> void
- type(*args, **kwargs)¶
Overloaded function.
type(self: pyrosetta.rosetta.protocols.moves.Mover, type_in: str) -> None
Set the ‘type’ string
C++: protocols::moves::Mover::type(const std::string &) –> void
type(self: pyrosetta.rosetta.protocols.moves.Mover) -> str
Get the set ‘type’ string
C++: protocols::moves::Mover::type() const –> const std::string &
- static xml_schema_complex_type_generator() utility::tag::XMLSchemaComplexTypeGenerator ¶
C++: protocols::enzymatic_movers::EnzymaticMover::xml_schema_complex_type_generator() –> class std::shared_ptr<class utility::tag::XMLSchemaComplexTypeGenerator>
- class pyrosetta.rosetta.protocols.enzymatic_movers.GlycosyltransferaseMoverCreator¶
Bases:
MoverCreator
MoverCreator allowing the MoverFactory to create a GlycosyltransferaseMover
- assign(self: pyrosetta.rosetta.protocols.enzymatic_movers.GlycosyltransferaseMoverCreator, : pyrosetta.rosetta.protocols.enzymatic_movers.GlycosyltransferaseMoverCreator) pyrosetta.rosetta.protocols.enzymatic_movers.GlycosyltransferaseMoverCreator ¶
C++: protocols::enzymatic_movers::GlycosyltransferaseMoverCreator::operator=(const class protocols::enzymatic_movers::GlycosyltransferaseMoverCreator &) –> class protocols::enzymatic_movers::GlycosyltransferaseMoverCreator &
- create_mover(self: pyrosetta.rosetta.protocols.enzymatic_movers.GlycosyltransferaseMoverCreator) pyrosetta.rosetta.protocols.moves.Mover ¶
Return an up-casted owning pointer (MoverOP) to the mover.
C++: protocols::enzymatic_movers::GlycosyltransferaseMoverCreator::create_mover() const –> class std::shared_ptr<class protocols::moves::Mover>
- keyname(self: pyrosetta.rosetta.protocols.enzymatic_movers.GlycosyltransferaseMoverCreator) str ¶
Return the key name for the associated Mover (GlycosyltransferaseMover).
C++: protocols::enzymatic_movers::GlycosyltransferaseMoverCreator::keyname() const –> std::string
- class pyrosetta.rosetta.protocols.enzymatic_movers.KinaseMover¶
Bases:
EnzymaticMover
This Mover simulates the activity of a virtual kinase enzyme on a Pose by phosphorylating a residue at a biologically relevant sequon position.
- apply(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, input_pose: pyrosetta.rosetta.core.pose.Pose) None ¶
Apply the corresponding move to <input_pose>.
C++: protocols::enzymatic_movers::EnzymaticMover::apply(class core::pose::Pose &) –> void
- assign(self: pyrosetta.rosetta.protocols.enzymatic_movers.KinaseMover, : pyrosetta.rosetta.protocols.enzymatic_movers.KinaseMover) pyrosetta.rosetta.protocols.enzymatic_movers.KinaseMover ¶
C++: protocols::enzymatic_movers::KinaseMover::operator=(const class protocols::enzymatic_movers::KinaseMover &) –> class protocols::enzymatic_movers::KinaseMover &
- clear_info(self: pyrosetta.rosetta.protocols.moves.Mover) None ¶
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.
clear_info is called by jd2 before calling apply
C++: protocols::moves::Mover::clear_info() –> void
- clone(self: pyrosetta.rosetta.protocols.enzymatic_movers.KinaseMover) pyrosetta.rosetta.protocols.moves.Mover ¶
C++: protocols::enzymatic_movers::KinaseMover::clone() const –> class std::shared_ptr<class protocols::moves::Mover>
- create(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.protocols.moves.Mover ¶
C++: protocols::moves::Mover::create() –> class std::shared_ptr<class protocols::moves::Mover>
- ensure_site(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, seqpos: int) None ¶
Definitely modify this site, if it is within a consensus sequence match for this enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::ensure_site(unsigned long) –> void
- exclude_site(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, seqpos: int) None ¶
Do not perform a reaction at this site, even if it is within a consensus sequence match for this enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::exclude_site(unsigned long) –> void
- fresh_instance(self: pyrosetta.rosetta.protocols.enzymatic_movers.KinaseMover) pyrosetta.rosetta.protocols.moves.Mover ¶
C++: protocols::enzymatic_movers::KinaseMover::fresh_instance() const –> class std::shared_ptr<class protocols::moves::Mover>
- get_additional_output(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.core.pose.Pose ¶
fpd
Mechanism by which a mover may return multiple output poses from a single input pose.
Supported in JD2. Will attempt to grab additional poses until a nullptr is returned.
C++: protocols::moves::Mover::get_additional_output() –> class std::shared_ptr<class core::pose::Pose>
- get_co_substrate(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, index: int) str ¶
Return the requested cosubstrate of this enzymatic reaction.
C++: protocols::enzymatic_movers::EnzymaticMover::get_co_substrate(const unsigned long) const –> const std::string &
- get_current_job(self: pyrosetta.rosetta.protocols.moves.Mover) protocols::jobdist::BasicJob ¶
C++: protocols::moves::Mover::get_current_job() const –> class std::shared_ptr<const class protocols::jobdist::BasicJob>
- get_current_tag(self: pyrosetta.rosetta.protocols.moves.Mover) str ¶
- 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.
C++: protocols::moves::Mover::get_current_tag() const –> std::string
- get_efficiency(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) float ¶
Get the efficiency of this enzyme.
An efficiency of 0.45 means that this enzyme will perform its reaction at any recognized site 45% of
the time.
C++: protocols::enzymatic_movers::EnzymaticMover::get_efficiency() const –> double
- get_ensured_sites(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) pyrosetta.rosetta.utility.vector1_unsigned_long ¶
- Return a list of sequence positions that are guaranteed to be modified, if they are within a consensus
sequence match for this enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::get_ensured_sites() const –> class utility::vector1<unsigned long, class std::allocator<unsigned long> >
- get_enzyme(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) str ¶
Return the specific name of this simulated enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::get_enzyme() const –> std::string
- get_enzyme_family(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) str ¶
Get the family name of this simulated enzyme.
This EnzymaticMover is a member of this enyzme family.
C++: protocols::enzymatic_movers::EnzymaticMover::get_enzyme_family() const –> std::string
- get_excluded_sites(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) pyrosetta.rosetta.utility.vector1_unsigned_long ¶
- Return a list of sequence positions that are forbidden from being modified, even if they are within a
consensus sequence match for this enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::get_excluded_sites() const –> class utility::vector1<unsigned long, class std::allocator<unsigned long> >
- get_input_pose(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.core.pose.Pose ¶
C++: protocols::moves::Mover::get_input_pose() const –> class std::shared_ptr<const class core::pose::Pose>
- get_last_move_status(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.protocols.moves.MoverStatus ¶
returns status after an apply(). The job distributor (august 08 vintage) will check this function to see if your protocol wants to filter its results - if your protocol wants to say “that run was no good, skip it” then use the protected last_move_status(MoverStatus) to change the value that this function will return.
C++: protocols::moves::Mover::get_last_move_status() const –> enum protocols::moves::MoverStatus
- get_n_co_substrates(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) int ¶
Return the current number of reactive sites.
C++: protocols::enzymatic_movers::EnzymaticMover::get_n_co_substrates() const –> unsigned long
- get_n_reactive_sites(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) int ¶
Return the current number of reactive sites.
C++: protocols::enzymatic_movers::EnzymaticMover::get_n_reactive_sites() const –> unsigned long
- get_name(self: pyrosetta.rosetta.protocols.enzymatic_movers.KinaseMover) str ¶
Return the name of the Mover.
C++: protocols::enzymatic_movers::KinaseMover::get_name() const –> std::string
- get_native_pose(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.core.pose.Pose ¶
C++: protocols::moves::Mover::get_native_pose() const –> class std::shared_ptr<const class core::pose::Pose>
- get_reactive_site_atom_name(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, index: int) str ¶
Return the atom name of the requested reactive site.
C++: protocols::enzymatic_movers::EnzymaticMover::get_reactive_site_atom_name(const unsigned long) const –> const std::string &
- get_reactive_site_sequence_position(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, index: int) int ¶
Return the sequence position of the requested reactive site.
C++: protocols::enzymatic_movers::EnzymaticMover::get_reactive_site_sequence_position(const unsigned long) const –> unsigned long
- get_self_ptr(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.protocols.moves.Mover ¶
C++: protocols::moves::Mover::get_self_ptr() –> class std::shared_ptr<class protocols::moves::Mover>
- get_self_weak_ptr(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.std.weak_ptr_protocols_moves_Mover_t ¶
C++: protocols::moves::Mover::get_self_weak_ptr() –> class std::weak_ptr<class protocols::moves::Mover>
- get_species(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) str ¶
Get the species name of this simulated enzyme.
This EnzymaticMover is limited to reactions known to occur in the returned species.
C++: protocols::enzymatic_movers::EnzymaticMover::get_species() const –> std::string
- get_type(self: pyrosetta.rosetta.protocols.moves.Mover) str ¶
C++: protocols::moves::Mover::get_type() const –> std::string
- info(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.std.list_std_string_t ¶
non-const accessor
C++: protocols::moves::Mover::info() –> class std::list<std::string, class std::allocator<std::string > > &
- last_proposal_density_ratio(self: pyrosetta.rosetta.protocols.moves.Mover) float ¶
C++: protocols::moves::Mover::last_proposal_density_ratio() –> double
- static mover_name() str ¶
C++: protocols::enzymatic_movers::KinaseMover::mover_name() –> std::string
- static name() str ¶
C++: protocols::moves::Mover::name() –> std::string
- parse_my_tag(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, tag: pyrosetta.rosetta.utility.tag.Tag, data: pyrosetta.rosetta.basic.datacache.DataMap) None ¶
C++: protocols::enzymatic_movers::EnzymaticMover::parse_my_tag(class std::shared_ptr<const class utility::tag::Tag>, class basic::datacache::DataMap &) –> void
- perform_all_reactions(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) None ¶
- Allow this EnzymaticMover to be promiscuous, performing a random transfer from among its possible
co-substrates.
C++: protocols::enzymatic_movers::EnzymaticMover::perform_all_reactions() –> void
- perform_major_reaction_only(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) None ¶
Set this EnzymaticMover to perform only its major reaction.
C++: protocols::enzymatic_movers::EnzymaticMover::perform_major_reaction_only() –> void
- performs_major_reaction_only(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) bool ¶
Does this enzyme only perform its major reaction?
C++: protocols::enzymatic_movers::EnzymaticMover::performs_major_reaction_only() const –> bool
- provide_citation_info(self: pyrosetta.rosetta.protocols.enzymatic_movers.KinaseMover, : pyrosetta.rosetta.basic.citation_manager.CitationCollectionList) None ¶
Provide the citation.
C++: protocols::enzymatic_movers::KinaseMover::provide_citation_info(class basic::citation_manager::CitationCollectionList &) const –> void
- static provide_xml_schema(xsd: utility::tag::XMLSchemaDefinition) None ¶
C++: protocols::enzymatic_movers::KinaseMover::provide_xml_schema(class utility::tag::XMLSchemaDefinition &) –> void
- static register_options() None ¶
Register options with the option system.
C++: protocols::enzymatic_movers::KinaseMover::register_options() –> void
- reinitialize_for_each_job(self: pyrosetta.rosetta.protocols.moves.Mover) bool ¶
- Inform the Job Distributor (August ‘08 vintage) whether this object needs to be freshly regenerated on
each use.
C++: protocols::moves::Mover::reinitialize_for_each_job() const –> bool
- reinitialize_for_new_input(self: pyrosetta.rosetta.protocols.moves.Mover) bool ¶
- 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).
C++: protocols::moves::Mover::reinitialize_for_new_input() const –> bool
- reset_status(self: pyrosetta.rosetta.protocols.moves.Mover) None ¶
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.
C++: protocols::moves::Mover::reset_status() –> void
- set_current_job(self: pyrosetta.rosetta.protocols.moves.Mover, job: protocols::jobdist::BasicJob) None ¶
C++: protocols::moves::Mover::set_current_job(class std::shared_ptr<const class protocols::jobdist::BasicJob>) –> void
- set_current_tag(self: pyrosetta.rosetta.protocols.moves.Mover, new_tag: str) None ¶
C++: protocols::moves::Mover::set_current_tag(const std::string &) –> void
- set_efficiency(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, setting: float) None ¶
Directly set the efficiency of this enzyme, ignoring whatever is in the database.
An efficiency of 0.45 means that this enzyme will perform its reaction at any recognized site 45% of
the time.
C++: protocols::enzymatic_movers::EnzymaticMover::set_efficiency(double) –> void
- set_ensured_sites(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, ensured_sites: pyrosetta.rosetta.utility.vector1_unsigned_long) None ¶
- Pass a list of sequence positions that are guaranteed to be modified, if they are within a consensus
sequence match for this enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::set_ensured_sites(const class utility::vector1<unsigned long, class std::allocator<unsigned long> > &) –> void
- set_enzyme(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, enzyme_name: str) None ¶
Set the specific name of this simulated enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::set_enzyme(const std::string &) –> void
- set_excluded_sites(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, excluded_sites: pyrosetta.rosetta.utility.vector1_unsigned_long) None ¶
- Pass a list of sequence positions that are forbidden from being modified, even if they are within a
consensus sequence match for this enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::set_excluded_sites(const class utility::vector1<unsigned long, class std::allocator<unsigned long> > &) –> void
- set_input_pose(self: pyrosetta.rosetta.protocols.moves.Mover, pose: pyrosetta.rosetta.core.pose.Pose) None ¶
setter for poses contained for rms
C++: protocols::moves::Mover::set_input_pose(class std::shared_ptr<const class core::pose::Pose>) –> void
- set_native_pose(self: pyrosetta.rosetta.protocols.moves.Mover, pose: pyrosetta.rosetta.core.pose.Pose) None ¶
setter for native poses contained for rms —- we should get rid of this method? it is widely used, but a bit unsafe
C++: protocols::moves::Mover::set_native_pose(class std::shared_ptr<const class core::pose::Pose>) –> void
- set_pose_reactive_sites(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, pose: pyrosetta.rosetta.core.pose.Pose) None ¶
C++: protocols::enzymatic_movers::EnzymaticMover::set_pose_reactive_sites(const class core::pose::Pose &) –> void
- set_species(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, species_name: str) None ¶
Set the species name of this simulated enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::set_species(const std::string &) –> void
- set_type(self: pyrosetta.rosetta.protocols.moves.Mover, setting: str) None ¶
Set the ‘type’ string
C++: protocols::moves::Mover::set_type(const std::string &) –> void
- show(*args, **kwargs)¶
Overloaded function.
show(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) -> None
show(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, output: pyrosetta.rosetta.std.ostream) -> None
Generate string representation of EnzymaticMover for debugging purposes.
C++: protocols::enzymatic_movers::EnzymaticMover::show(std::ostream &) const –> void
- test_move(self: pyrosetta.rosetta.protocols.moves.Mover, pose: pyrosetta.rosetta.core.pose.Pose) None ¶
- : Unit test support function. Apply one move to a given pose.
Allows extra test specific functions to be called before applying
C++: protocols::moves::Mover::test_move(class core::pose::Pose &) –> void
- type(*args, **kwargs)¶
Overloaded function.
type(self: pyrosetta.rosetta.protocols.moves.Mover, type_in: str) -> None
Set the ‘type’ string
C++: protocols::moves::Mover::type(const std::string &) –> void
type(self: pyrosetta.rosetta.protocols.moves.Mover) -> str
Get the set ‘type’ string
C++: protocols::moves::Mover::type() const –> const std::string &
- static xml_schema_complex_type_generator() utility::tag::XMLSchemaComplexTypeGenerator ¶
C++: protocols::enzymatic_movers::EnzymaticMover::xml_schema_complex_type_generator() –> class std::shared_ptr<class utility::tag::XMLSchemaComplexTypeGenerator>
- class pyrosetta.rosetta.protocols.enzymatic_movers.KinaseMoverCreator¶
Bases:
MoverCreator
MoverCreator allowing the MoverFactory to create a KinaseMover
- assign(self: pyrosetta.rosetta.protocols.enzymatic_movers.KinaseMoverCreator, : pyrosetta.rosetta.protocols.enzymatic_movers.KinaseMoverCreator) pyrosetta.rosetta.protocols.enzymatic_movers.KinaseMoverCreator ¶
C++: protocols::enzymatic_movers::KinaseMoverCreator::operator=(const class protocols::enzymatic_movers::KinaseMoverCreator &) –> class protocols::enzymatic_movers::KinaseMoverCreator &
- create_mover(self: pyrosetta.rosetta.protocols.enzymatic_movers.KinaseMoverCreator) pyrosetta.rosetta.protocols.moves.Mover ¶
Return an up-casted owning pointer (MoverOP) to the mover.
C++: protocols::enzymatic_movers::KinaseMoverCreator::create_mover() const –> class std::shared_ptr<class protocols::moves::Mover>
- keyname(self: pyrosetta.rosetta.protocols.enzymatic_movers.KinaseMoverCreator) str ¶
Return the key name for the associated Mover (KinaseMover).
C++: protocols::enzymatic_movers::KinaseMoverCreator::keyname() const –> std::string
- class pyrosetta.rosetta.protocols.enzymatic_movers.NTerminalAcetyltransferaseMover¶
Bases:
EnzymaticMover
This Mover simulates the activity of a virtual N-terminal acetyltransferase enzyme on a Pose by acetylating the N-terminus of a peptide at a biologically relevant sequon position.
- apply(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, input_pose: pyrosetta.rosetta.core.pose.Pose) None ¶
Apply the corresponding move to <input_pose>.
C++: protocols::enzymatic_movers::EnzymaticMover::apply(class core::pose::Pose &) –> void
- assign(self: pyrosetta.rosetta.protocols.enzymatic_movers.NTerminalAcetyltransferaseMover, : pyrosetta.rosetta.protocols.enzymatic_movers.NTerminalAcetyltransferaseMover) pyrosetta.rosetta.protocols.enzymatic_movers.NTerminalAcetyltransferaseMover ¶
C++: protocols::enzymatic_movers::NTerminalAcetyltransferaseMover::operator=(const class protocols::enzymatic_movers::NTerminalAcetyltransferaseMover &) –> class protocols::enzymatic_movers::NTerminalAcetyltransferaseMover &
- clear_info(self: pyrosetta.rosetta.protocols.moves.Mover) None ¶
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.
clear_info is called by jd2 before calling apply
C++: protocols::moves::Mover::clear_info() –> void
- clone(self: pyrosetta.rosetta.protocols.enzymatic_movers.NTerminalAcetyltransferaseMover) pyrosetta.rosetta.protocols.moves.Mover ¶
C++: protocols::enzymatic_movers::NTerminalAcetyltransferaseMover::clone() const –> class std::shared_ptr<class protocols::moves::Mover>
- create(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.protocols.moves.Mover ¶
C++: protocols::moves::Mover::create() –> class std::shared_ptr<class protocols::moves::Mover>
- ensure_site(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, seqpos: int) None ¶
Definitely modify this site, if it is within a consensus sequence match for this enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::ensure_site(unsigned long) –> void
- exclude_site(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, seqpos: int) None ¶
Do not perform a reaction at this site, even if it is within a consensus sequence match for this enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::exclude_site(unsigned long) –> void
- fresh_instance(self: pyrosetta.rosetta.protocols.enzymatic_movers.NTerminalAcetyltransferaseMover) pyrosetta.rosetta.protocols.moves.Mover ¶
C++: protocols::enzymatic_movers::NTerminalAcetyltransferaseMover::fresh_instance() const –> class std::shared_ptr<class protocols::moves::Mover>
- get_additional_output(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.core.pose.Pose ¶
fpd
Mechanism by which a mover may return multiple output poses from a single input pose.
Supported in JD2. Will attempt to grab additional poses until a nullptr is returned.
C++: protocols::moves::Mover::get_additional_output() –> class std::shared_ptr<class core::pose::Pose>
- get_co_substrate(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, index: int) str ¶
Return the requested cosubstrate of this enzymatic reaction.
C++: protocols::enzymatic_movers::EnzymaticMover::get_co_substrate(const unsigned long) const –> const std::string &
- get_current_job(self: pyrosetta.rosetta.protocols.moves.Mover) protocols::jobdist::BasicJob ¶
C++: protocols::moves::Mover::get_current_job() const –> class std::shared_ptr<const class protocols::jobdist::BasicJob>
- get_current_tag(self: pyrosetta.rosetta.protocols.moves.Mover) str ¶
- 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.
C++: protocols::moves::Mover::get_current_tag() const –> std::string
- get_efficiency(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) float ¶
Get the efficiency of this enzyme.
An efficiency of 0.45 means that this enzyme will perform its reaction at any recognized site 45% of
the time.
C++: protocols::enzymatic_movers::EnzymaticMover::get_efficiency() const –> double
- get_ensured_sites(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) pyrosetta.rosetta.utility.vector1_unsigned_long ¶
- Return a list of sequence positions that are guaranteed to be modified, if they are within a consensus
sequence match for this enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::get_ensured_sites() const –> class utility::vector1<unsigned long, class std::allocator<unsigned long> >
- get_enzyme(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) str ¶
Return the specific name of this simulated enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::get_enzyme() const –> std::string
- get_enzyme_family(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) str ¶
Get the family name of this simulated enzyme.
This EnzymaticMover is a member of this enyzme family.
C++: protocols::enzymatic_movers::EnzymaticMover::get_enzyme_family() const –> std::string
- get_excluded_sites(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) pyrosetta.rosetta.utility.vector1_unsigned_long ¶
- Return a list of sequence positions that are forbidden from being modified, even if they are within a
consensus sequence match for this enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::get_excluded_sites() const –> class utility::vector1<unsigned long, class std::allocator<unsigned long> >
- get_input_pose(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.core.pose.Pose ¶
C++: protocols::moves::Mover::get_input_pose() const –> class std::shared_ptr<const class core::pose::Pose>
- get_last_move_status(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.protocols.moves.MoverStatus ¶
returns status after an apply(). The job distributor (august 08 vintage) will check this function to see if your protocol wants to filter its results - if your protocol wants to say “that run was no good, skip it” then use the protected last_move_status(MoverStatus) to change the value that this function will return.
C++: protocols::moves::Mover::get_last_move_status() const –> enum protocols::moves::MoverStatus
- get_n_co_substrates(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) int ¶
Return the current number of reactive sites.
C++: protocols::enzymatic_movers::EnzymaticMover::get_n_co_substrates() const –> unsigned long
- get_n_reactive_sites(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) int ¶
Return the current number of reactive sites.
C++: protocols::enzymatic_movers::EnzymaticMover::get_n_reactive_sites() const –> unsigned long
- get_name(self: pyrosetta.rosetta.protocols.enzymatic_movers.NTerminalAcetyltransferaseMover) str ¶
Return the name of the Mover.
C++: protocols::enzymatic_movers::NTerminalAcetyltransferaseMover::get_name() const –> std::string
- get_native_pose(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.core.pose.Pose ¶
C++: protocols::moves::Mover::get_native_pose() const –> class std::shared_ptr<const class core::pose::Pose>
- get_reactive_site_atom_name(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, index: int) str ¶
Return the atom name of the requested reactive site.
C++: protocols::enzymatic_movers::EnzymaticMover::get_reactive_site_atom_name(const unsigned long) const –> const std::string &
- get_reactive_site_sequence_position(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, index: int) int ¶
Return the sequence position of the requested reactive site.
C++: protocols::enzymatic_movers::EnzymaticMover::get_reactive_site_sequence_position(const unsigned long) const –> unsigned long
- get_self_ptr(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.protocols.moves.Mover ¶
C++: protocols::moves::Mover::get_self_ptr() –> class std::shared_ptr<class protocols::moves::Mover>
- get_self_weak_ptr(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.std.weak_ptr_protocols_moves_Mover_t ¶
C++: protocols::moves::Mover::get_self_weak_ptr() –> class std::weak_ptr<class protocols::moves::Mover>
- get_species(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) str ¶
Get the species name of this simulated enzyme.
This EnzymaticMover is limited to reactions known to occur in the returned species.
C++: protocols::enzymatic_movers::EnzymaticMover::get_species() const –> std::string
- get_type(self: pyrosetta.rosetta.protocols.moves.Mover) str ¶
C++: protocols::moves::Mover::get_type() const –> std::string
- info(self: pyrosetta.rosetta.protocols.moves.Mover) pyrosetta.rosetta.std.list_std_string_t ¶
non-const accessor
C++: protocols::moves::Mover::info() –> class std::list<std::string, class std::allocator<std::string > > &
- last_proposal_density_ratio(self: pyrosetta.rosetta.protocols.moves.Mover) float ¶
C++: protocols::moves::Mover::last_proposal_density_ratio() –> double
- static mover_name() str ¶
C++: protocols::enzymatic_movers::NTerminalAcetyltransferaseMover::mover_name() –> std::string
- static name() str ¶
C++: protocols::moves::Mover::name() –> std::string
- parse_my_tag(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, tag: pyrosetta.rosetta.utility.tag.Tag, data: pyrosetta.rosetta.basic.datacache.DataMap) None ¶
C++: protocols::enzymatic_movers::EnzymaticMover::parse_my_tag(class std::shared_ptr<const class utility::tag::Tag>, class basic::datacache::DataMap &) –> void
- perform_all_reactions(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) None ¶
- Allow this EnzymaticMover to be promiscuous, performing a random transfer from among its possible
co-substrates.
C++: protocols::enzymatic_movers::EnzymaticMover::perform_all_reactions() –> void
- perform_major_reaction_only(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) None ¶
Set this EnzymaticMover to perform only its major reaction.
C++: protocols::enzymatic_movers::EnzymaticMover::perform_major_reaction_only() –> void
- performs_major_reaction_only(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) bool ¶
Does this enzyme only perform its major reaction?
C++: protocols::enzymatic_movers::EnzymaticMover::performs_major_reaction_only() const –> bool
- provide_citation_info(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, : pyrosetta.rosetta.basic.citation_manager.CitationCollectionList) None ¶
Provide the citation.
C++: protocols::enzymatic_movers::EnzymaticMover::provide_citation_info(class basic::citation_manager::CitationCollectionList &) const –> void
- static provide_xml_schema(xsd: utility::tag::XMLSchemaDefinition) None ¶
C++: protocols::enzymatic_movers::NTerminalAcetyltransferaseMover::provide_xml_schema(class utility::tag::XMLSchemaDefinition &) –> void
- static register_options() None ¶
Register options with the option system.
C++: protocols::enzymatic_movers::NTerminalAcetyltransferaseMover::register_options() –> void
- reinitialize_for_each_job(self: pyrosetta.rosetta.protocols.moves.Mover) bool ¶
- Inform the Job Distributor (August ‘08 vintage) whether this object needs to be freshly regenerated on
each use.
C++: protocols::moves::Mover::reinitialize_for_each_job() const –> bool
- reinitialize_for_new_input(self: pyrosetta.rosetta.protocols.moves.Mover) bool ¶
- 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).
C++: protocols::moves::Mover::reinitialize_for_new_input() const –> bool
- reset_status(self: pyrosetta.rosetta.protocols.moves.Mover) None ¶
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.
C++: protocols::moves::Mover::reset_status() –> void
- set_current_job(self: pyrosetta.rosetta.protocols.moves.Mover, job: protocols::jobdist::BasicJob) None ¶
C++: protocols::moves::Mover::set_current_job(class std::shared_ptr<const class protocols::jobdist::BasicJob>) –> void
- set_current_tag(self: pyrosetta.rosetta.protocols.moves.Mover, new_tag: str) None ¶
C++: protocols::moves::Mover::set_current_tag(const std::string &) –> void
- set_efficiency(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, setting: float) None ¶
Directly set the efficiency of this enzyme, ignoring whatever is in the database.
An efficiency of 0.45 means that this enzyme will perform its reaction at any recognized site 45% of
the time.
C++: protocols::enzymatic_movers::EnzymaticMover::set_efficiency(double) –> void
- set_ensured_sites(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, ensured_sites: pyrosetta.rosetta.utility.vector1_unsigned_long) None ¶
- Pass a list of sequence positions that are guaranteed to be modified, if they are within a consensus
sequence match for this enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::set_ensured_sites(const class utility::vector1<unsigned long, class std::allocator<unsigned long> > &) –> void
- set_enzyme(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, enzyme_name: str) None ¶
Set the specific name of this simulated enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::set_enzyme(const std::string &) –> void
- set_excluded_sites(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, excluded_sites: pyrosetta.rosetta.utility.vector1_unsigned_long) None ¶
- Pass a list of sequence positions that are forbidden from being modified, even if they are within a
consensus sequence match for this enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::set_excluded_sites(const class utility::vector1<unsigned long, class std::allocator<unsigned long> > &) –> void
- set_input_pose(self: pyrosetta.rosetta.protocols.moves.Mover, pose: pyrosetta.rosetta.core.pose.Pose) None ¶
setter for poses contained for rms
C++: protocols::moves::Mover::set_input_pose(class std::shared_ptr<const class core::pose::Pose>) –> void
- set_native_pose(self: pyrosetta.rosetta.protocols.moves.Mover, pose: pyrosetta.rosetta.core.pose.Pose) None ¶
setter for native poses contained for rms —- we should get rid of this method? it is widely used, but a bit unsafe
C++: protocols::moves::Mover::set_native_pose(class std::shared_ptr<const class core::pose::Pose>) –> void
- set_pose_reactive_sites(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, pose: pyrosetta.rosetta.core.pose.Pose) None ¶
C++: protocols::enzymatic_movers::EnzymaticMover::set_pose_reactive_sites(const class core::pose::Pose &) –> void
- set_species(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, species_name: str) None ¶
Set the species name of this simulated enzyme.
C++: protocols::enzymatic_movers::EnzymaticMover::set_species(const std::string &) –> void
- set_type(self: pyrosetta.rosetta.protocols.moves.Mover, setting: str) None ¶
Set the ‘type’ string
C++: protocols::moves::Mover::set_type(const std::string &) –> void
- show(*args, **kwargs)¶
Overloaded function.
show(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover) -> None
show(self: pyrosetta.rosetta.protocols.enzymatic_movers.EnzymaticMover, output: pyrosetta.rosetta.std.ostream) -> None
Generate string representation of EnzymaticMover for debugging purposes.
C++: protocols::enzymatic_movers::EnzymaticMover::show(std::ostream &) const –> void
- test_move(self: pyrosetta.rosetta.protocols.moves.Mover, pose: pyrosetta.rosetta.core.pose.Pose) None ¶
- : Unit test support function. Apply one move to a given pose.
Allows extra test specific functions to be called before applying
C++: protocols::moves::Mover::test_move(class core::pose::Pose &) –> void
- type(*args, **kwargs)¶
Overloaded function.
type(self: pyrosetta.rosetta.protocols.moves.Mover, type_in: str) -> None
Set the ‘type’ string
C++: protocols::moves::Mover::type(const std::string &) –> void
type(self: pyrosetta.rosetta.protocols.moves.Mover) -> str
Get the set ‘type’ string
C++: protocols::moves::Mover::type() const –> const std::string &
- static xml_schema_complex_type_generator() utility::tag::XMLSchemaComplexTypeGenerator ¶
C++: protocols::enzymatic_movers::EnzymaticMover::xml_schema_complex_type_generator() –> class std::shared_ptr<class utility::tag::XMLSchemaComplexTypeGenerator>
- class pyrosetta.rosetta.protocols.enzymatic_movers.NTerminalAcetyltransferaseMoverCreator¶
Bases:
MoverCreator
MoverCreator allowing the MoverFactory to create an NTerminalAcetyltransferaseMover.
- assign(self: pyrosetta.rosetta.protocols.enzymatic_movers.NTerminalAcetyltransferaseMoverCreator, : pyrosetta.rosetta.protocols.enzymatic_movers.NTerminalAcetyltransferaseMoverCreator) pyrosetta.rosetta.protocols.enzymatic_movers.NTerminalAcetyltransferaseMoverCreator ¶
C++: protocols::enzymatic_movers::NTerminalAcetyltransferaseMoverCreator::operator=(const class protocols::enzymatic_movers::NTerminalAcetyltransferaseMoverCreator &) –> class protocols::enzymatic_movers::NTerminalAcetyltransferaseMoverCreator &
- create_mover(self: pyrosetta.rosetta.protocols.enzymatic_movers.NTerminalAcetyltransferaseMoverCreator) pyrosetta.rosetta.protocols.moves.Mover ¶
Return an up-casted owning pointer (MoverOP) to the mover.
C++: protocols::enzymatic_movers::NTerminalAcetyltransferaseMoverCreator::create_mover() const –> class std::shared_ptr<class protocols::moves::Mover>
- keyname(self: pyrosetta.rosetta.protocols.enzymatic_movers.NTerminalAcetyltransferaseMoverCreator) str ¶
Return the key name for the associated Mover (NTerminalAcetyltransferaseMover).
C++: protocols::enzymatic_movers::NTerminalAcetyltransferaseMoverCreator::keyname() const –> std::string
- provide_xml_schema(self: pyrosetta.rosetta.protocols.enzymatic_movers.NTerminalAcetyltransferaseMoverCreator, xsd: utility::tag::XMLSchemaDefinition) None ¶
C++: protocols::enzymatic_movers::NTerminalAcetyltransferaseMoverCreator::provide_xml_schema(class utility::tag::XMLSchemaDefinition &) const –> void