flxbb¶
Bindings for protocols::flxbb namespace
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class
pyrosetta.rosetta.protocols.flxbb.
DesignTask
¶ Bases:
pybind11_builtins.pybind11_object
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add_task_operation
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask, top: pyrosetta.rosetta.core.pack.task.operation.TaskOperation) → None¶ add task operation
C++: protocols::flxbb::DesignTask::add_task_operation(const class std::shared_ptr<class core::pack::task::operation::TaskOperation>) –> void
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add_task_operations
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask, top: pyrosetta.rosetta.utility.vector1_std_shared_ptr_core_pack_task_operation_TaskOperation_t) → None¶ add task operations
C++: protocols::flxbb::DesignTask::add_task_operations(const class utility::vector1<class std::shared_ptr<class core::pack::task::operation::TaskOperation>, class std::allocator<class std::shared_ptr<class core::pack::task::operation::TaskOperation> > > &) –> void
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assign
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask, : pyrosetta.rosetta.protocols.flxbb.DesignTask) → pyrosetta.rosetta.protocols.flxbb.DesignTask¶ C++: protocols::flxbb::DesignTask::operator=(const class protocols::flxbb::DesignTask &) –> class protocols::flxbb::DesignTask &
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dump_packertask
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask, os: pyrosetta.rosetta.std.ostream) → None¶ output packertask
C++: protocols::flxbb::DesignTask::dump_packertask(class std::basic_ostream<char> &) –> void
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filter_structs
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask) → protocols::flxbb::FilterStructs¶ filter during fixbb design
C++: protocols::flxbb::DesignTask::filter_structs() const –> class std::shared_ptr<class protocols::flxbb::FilterStructs>
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mover
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask) → pyrosetta.rosetta.protocols.moves.Mover¶ mover after fixbb design
C++: protocols::flxbb::DesignTask::mover() const –> class std::shared_ptr<class protocols::moves::Mover>
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ncycle
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask) → int¶ the number of cycles of fixbb design and mover
C++: protocols::flxbb::DesignTask::ncycle() const –> unsigned long
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packertask
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask) → pyrosetta.rosetta.core.pack.task.PackerTask¶ packer task for fixbb design
C++: protocols::flxbb::DesignTask::packertask() const –> class std::shared_ptr<class core::pack::task::PackerTask>
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resfile
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask) → str¶ resfile
C++: protocols::flxbb::DesignTask::resfile() const –> std::string
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scorefxn
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask) → pyrosetta.rosetta.core.scoring.ScoreFunction¶ scorefxn for fixbb design
C++: protocols::flxbb::DesignTask::scorefxn() const –> class std::shared_ptr<class core::scoring::ScoreFunction>
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set_filter_structs
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask, value: protocols::flxbb::FilterStructs) → None¶ filter during fixbb design
C++: protocols::flxbb::DesignTask::set_filter_structs(const class std::shared_ptr<class protocols::flxbb::FilterStructs>) –> void
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set_mover
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask, value: pyrosetta.rosetta.protocols.moves.Mover) → None¶ mover after fixbb design
C++: protocols::flxbb::DesignTask::set_mover(const class std::shared_ptr<class protocols::moves::Mover>) –> void
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set_ncycle
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask, ncycle: int) → None¶ the number of cycles of design and mover
C++: protocols::flxbb::DesignTask::set_ncycle(const unsigned long &) –> void
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set_packertask
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask, taskf: pyrosetta.rosetta.core.pack.task.PackerTask) → None¶ packer task
C++: protocols::flxbb::DesignTask::set_packertask(const class std::shared_ptr<class core::pack::task::PackerTask>) –> void
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set_resfile
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask, resfile: str) → None¶ set resfile
C++: protocols::flxbb::DesignTask::set_resfile(const class std::basic_string<char> &) –> void
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set_scorefxn
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask, sfxn: pyrosetta.rosetta.core.scoring.ScoreFunction) → None¶ scorefxn for fixbb design
C++: protocols::flxbb::DesignTask::set_scorefxn(const class std::shared_ptr<class core::scoring::ScoreFunction>) –> void
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setup
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask, : pyrosetta.rosetta.core.pose.Pose, : pyrosetta.rosetta.core.pack.task.PackerTask) → None¶ setup packer task
C++: protocols::flxbb::DesignTask::setup(const class core::pose::Pose &, const class std::shared_ptr<class core::pack::task::PackerTask>) –> void
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class
pyrosetta.rosetta.protocols.flxbb.
DesignTask_Layer
¶ Bases:
pyrosetta.rosetta.protocols.flxbb.DesignTask
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add_task_operation
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask, top: pyrosetta.rosetta.core.pack.task.operation.TaskOperation) → None¶ add task operation
C++: protocols::flxbb::DesignTask::add_task_operation(const class std::shared_ptr<class core::pack::task::operation::TaskOperation>) –> void
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add_task_operations
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask, top: pyrosetta.rosetta.utility.vector1_std_shared_ptr_core_pack_task_operation_TaskOperation_t) → None¶ add task operations
C++: protocols::flxbb::DesignTask::add_task_operations(const class utility::vector1<class std::shared_ptr<class core::pack::task::operation::TaskOperation>, class std::allocator<class std::shared_ptr<class core::pack::task::operation::TaskOperation> > > &) –> void
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assign
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask_Layer, : pyrosetta.rosetta.protocols.flxbb.DesignTask_Layer) → pyrosetta.rosetta.protocols.flxbb.DesignTask_Layer¶ C++: protocols::flxbb::DesignTask_Layer::operator=(const class protocols::flxbb::DesignTask_Layer &) –> class protocols::flxbb::DesignTask_Layer &
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dump_packertask
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask, os: pyrosetta.rosetta.std.ostream) → None¶ output packertask
C++: protocols::flxbb::DesignTask::dump_packertask(class std::basic_ostream<char> &) –> void
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filter_structs
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask) → protocols::flxbb::FilterStructs¶ filter during fixbb design
C++: protocols::flxbb::DesignTask::filter_structs() const –> class std::shared_ptr<class protocols::flxbb::FilterStructs>
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mover
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask) → pyrosetta.rosetta.protocols.moves.Mover¶ mover after fixbb design
C++: protocols::flxbb::DesignTask::mover() const –> class std::shared_ptr<class protocols::moves::Mover>
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ncycle
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask) → int¶ the number of cycles of fixbb design and mover
C++: protocols::flxbb::DesignTask::ncycle() const –> unsigned long
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packertask
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask) → pyrosetta.rosetta.core.pack.task.PackerTask¶ packer task for fixbb design
C++: protocols::flxbb::DesignTask::packertask() const –> class std::shared_ptr<class core::pack::task::PackerTask>
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resfile
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask) → str¶ resfile
C++: protocols::flxbb::DesignTask::resfile() const –> std::string
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scorefxn
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask) → pyrosetta.rosetta.core.scoring.ScoreFunction¶ scorefxn for fixbb design
C++: protocols::flxbb::DesignTask::scorefxn() const –> class std::shared_ptr<class core::scoring::ScoreFunction>
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set_filter_structs
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask, value: protocols::flxbb::FilterStructs) → None¶ filter during fixbb design
C++: protocols::flxbb::DesignTask::set_filter_structs(const class std::shared_ptr<class protocols::flxbb::FilterStructs>) –> void
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set_mover
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask, value: pyrosetta.rosetta.protocols.moves.Mover) → None¶ mover after fixbb design
C++: protocols::flxbb::DesignTask::set_mover(const class std::shared_ptr<class protocols::moves::Mover>) –> void
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set_ncycle
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask, ncycle: int) → None¶ the number of cycles of design and mover
C++: protocols::flxbb::DesignTask::set_ncycle(const unsigned long &) –> void
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set_packertask
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask, taskf: pyrosetta.rosetta.core.pack.task.PackerTask) → None¶ packer task
C++: protocols::flxbb::DesignTask::set_packertask(const class std::shared_ptr<class core::pack::task::PackerTask>) –> void
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set_resfile
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask, resfile: str) → None¶ set resfile
C++: protocols::flxbb::DesignTask::set_resfile(const class std::basic_string<char> &) –> void
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set_scorefxn
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask, sfxn: pyrosetta.rosetta.core.scoring.ScoreFunction) → None¶ scorefxn for fixbb design
C++: protocols::flxbb::DesignTask::set_scorefxn(const class std::shared_ptr<class core::scoring::ScoreFunction>) –> void
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setup
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask_Layer, pose: pyrosetta.rosetta.core.pose.Pose, task: pyrosetta.rosetta.core.pack.task.PackerTask) → None¶ C++: protocols::flxbb::DesignTask_Layer::setup(const class core::pose::Pose &, const class std::shared_ptr<class core::pack::task::PackerTask>) –> void
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class
pyrosetta.rosetta.protocols.flxbb.
DesignTask_Normal
¶ Bases:
pyrosetta.rosetta.protocols.flxbb.DesignTask
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add_task_operation
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask, top: pyrosetta.rosetta.core.pack.task.operation.TaskOperation) → None¶ add task operation
C++: protocols::flxbb::DesignTask::add_task_operation(const class std::shared_ptr<class core::pack::task::operation::TaskOperation>) –> void
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add_task_operations
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask, top: pyrosetta.rosetta.utility.vector1_std_shared_ptr_core_pack_task_operation_TaskOperation_t) → None¶ add task operations
C++: protocols::flxbb::DesignTask::add_task_operations(const class utility::vector1<class std::shared_ptr<class core::pack::task::operation::TaskOperation>, class std::allocator<class std::shared_ptr<class core::pack::task::operation::TaskOperation> > > &) –> void
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assign
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask_Normal, : pyrosetta.rosetta.protocols.flxbb.DesignTask_Normal) → pyrosetta.rosetta.protocols.flxbb.DesignTask_Normal¶ C++: protocols::flxbb::DesignTask_Normal::operator=(const class protocols::flxbb::DesignTask_Normal &) –> class protocols::flxbb::DesignTask_Normal &
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dump_packertask
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask, os: pyrosetta.rosetta.std.ostream) → None¶ output packertask
C++: protocols::flxbb::DesignTask::dump_packertask(class std::basic_ostream<char> &) –> void
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filter_structs
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask) → protocols::flxbb::FilterStructs¶ filter during fixbb design
C++: protocols::flxbb::DesignTask::filter_structs() const –> class std::shared_ptr<class protocols::flxbb::FilterStructs>
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mover
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask) → pyrosetta.rosetta.protocols.moves.Mover¶ mover after fixbb design
C++: protocols::flxbb::DesignTask::mover() const –> class std::shared_ptr<class protocols::moves::Mover>
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ncycle
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask) → int¶ the number of cycles of fixbb design and mover
C++: protocols::flxbb::DesignTask::ncycle() const –> unsigned long
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packertask
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask) → pyrosetta.rosetta.core.pack.task.PackerTask¶ packer task for fixbb design
C++: protocols::flxbb::DesignTask::packertask() const –> class std::shared_ptr<class core::pack::task::PackerTask>
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resfile
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask) → str¶ resfile
C++: protocols::flxbb::DesignTask::resfile() const –> std::string
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scorefxn
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask) → pyrosetta.rosetta.core.scoring.ScoreFunction¶ scorefxn for fixbb design
C++: protocols::flxbb::DesignTask::scorefxn() const –> class std::shared_ptr<class core::scoring::ScoreFunction>
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set_filter_structs
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask, value: protocols::flxbb::FilterStructs) → None¶ filter during fixbb design
C++: protocols::flxbb::DesignTask::set_filter_structs(const class std::shared_ptr<class protocols::flxbb::FilterStructs>) –> void
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set_mover
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask, value: pyrosetta.rosetta.protocols.moves.Mover) → None¶ mover after fixbb design
C++: protocols::flxbb::DesignTask::set_mover(const class std::shared_ptr<class protocols::moves::Mover>) –> void
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set_ncycle
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask, ncycle: int) → None¶ the number of cycles of design and mover
C++: protocols::flxbb::DesignTask::set_ncycle(const unsigned long &) –> void
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set_packertask
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask, taskf: pyrosetta.rosetta.core.pack.task.PackerTask) → None¶ packer task
C++: protocols::flxbb::DesignTask::set_packertask(const class std::shared_ptr<class core::pack::task::PackerTask>) –> void
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set_resfile
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask, resfile: str) → None¶ set resfile
C++: protocols::flxbb::DesignTask::set_resfile(const class std::basic_string<char> &) –> void
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set_scorefxn
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask, sfxn: pyrosetta.rosetta.core.scoring.ScoreFunction) → None¶ scorefxn for fixbb design
C++: protocols::flxbb::DesignTask::set_scorefxn(const class std::shared_ptr<class core::scoring::ScoreFunction>) –> void
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setup
(self: pyrosetta.rosetta.protocols.flxbb.DesignTask_Normal, pose: pyrosetta.rosetta.core.pose.Pose, task: pyrosetta.rosetta.core.pack.task.PackerTask) → None¶ C++: protocols::flxbb::DesignTask_Normal::setup(const class core::pose::Pose &, const class std::shared_ptr<class core::pack::task::PackerTask>) –> void
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class
pyrosetta.rosetta.protocols.flxbb.
FilterStructs
¶ Bases:
pybind11_builtins.pybind11_object
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apply
(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs, : pyrosetta.rosetta.core.pose.Pose) → None¶ C++: protocols::flxbb::FilterStructs::apply(const class core::pose::Pose &) –> void
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assign
(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs, : pyrosetta.rosetta.protocols.flxbb.FilterStructs) → pyrosetta.rosetta.protocols.flxbb.FilterStructs¶ C++: protocols::flxbb::FilterStructs::operator=(const class protocols::flxbb::FilterStructs &) –> class protocols::flxbb::FilterStructs &
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clone
(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs) → pyrosetta.rosetta.protocols.flxbb.FilterStructs¶ C++: protocols::flxbb::FilterStructs::clone() const –> class std::shared_ptr<class protocols::flxbb::FilterStructs>
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current_trial
(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs) → int¶ C++: protocols::flxbb::FilterStructs::current_trial() const –> unsigned long
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filter_on
(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs) → bool¶ C++: protocols::flxbb::FilterStructs::filter_on() const –> bool
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fresh_instance
(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs) → pyrosetta.rosetta.protocols.flxbb.FilterStructs¶ C++: protocols::flxbb::FilterStructs::fresh_instance() const –> class std::shared_ptr<class protocols::flxbb::FilterStructs>
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get_bestpose
(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs) → pyrosetta.rosetta.core.pose.Pose¶ C++: protocols::flxbb::FilterStructs::get_bestpose() const –> class std::shared_ptr<class core::pose::Pose>
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name
(*args, **kwargs)¶ Overloaded function.
- name(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs) -> str
C++: protocols::flxbb::FilterStructs::name() const –> std::string
- name(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs, name: str) -> None
C++: protocols::flxbb::FilterStructs::name(const class std::basic_string<char> &) –> void
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reset
(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs, : pyrosetta.rosetta.core.pose.Pose) → None¶ C++: protocols::flxbb::FilterStructs::reset(const class core::pose::Pose &) –> void
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set_ntrial
(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs, ntrial: int) → None¶ C++: protocols::flxbb::FilterStructs::set_ntrial(const unsigned long) –> void
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class
pyrosetta.rosetta.protocols.flxbb.
FilterStructs_Packstat
¶ Bases:
pyrosetta.rosetta.protocols.flxbb.FilterStructs
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apply
(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs_Packstat, : pyrosetta.rosetta.core.pose.Pose) → None¶ C++: protocols::flxbb::FilterStructs_Packstat::apply(const class core::pose::Pose &) –> void
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assign
(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs_Packstat, : pyrosetta.rosetta.protocols.flxbb.FilterStructs_Packstat) → pyrosetta.rosetta.protocols.flxbb.FilterStructs_Packstat¶ C++: protocols::flxbb::FilterStructs_Packstat::operator=(const class protocols::flxbb::FilterStructs_Packstat &) –> class protocols::flxbb::FilterStructs_Packstat &
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clone
(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs_Packstat) → pyrosetta.rosetta.protocols.flxbb.FilterStructs¶ C++: protocols::flxbb::FilterStructs_Packstat::clone() const –> class std::shared_ptr<class protocols::flxbb::FilterStructs>
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current_trial
(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs) → int¶ C++: protocols::flxbb::FilterStructs::current_trial() const –> unsigned long
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filter_on
(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs) → bool¶ C++: protocols::flxbb::FilterStructs::filter_on() const –> bool
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fresh_instance
(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs_Packstat) → pyrosetta.rosetta.protocols.flxbb.FilterStructs¶ C++: protocols::flxbb::FilterStructs_Packstat::fresh_instance() const –> class std::shared_ptr<class protocols::flxbb::FilterStructs>
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get_bestpose
(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs) → pyrosetta.rosetta.core.pose.Pose¶ C++: protocols::flxbb::FilterStructs::get_bestpose() const –> class std::shared_ptr<class core::pose::Pose>
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name
(*args, **kwargs)¶ Overloaded function.
- name(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs) -> str
C++: protocols::flxbb::FilterStructs::name() const –> std::string
- name(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs, name: str) -> None
C++: protocols::flxbb::FilterStructs::name(const class std::basic_string<char> &) –> void
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reset
(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs_Packstat, : pyrosetta.rosetta.core.pose.Pose) → None¶ C++: protocols::flxbb::FilterStructs_Packstat::reset(const class core::pose::Pose &) –> void
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set_ntrial
(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs, ntrial: int) → None¶ C++: protocols::flxbb::FilterStructs::set_ntrial(const unsigned long) –> void
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class
pyrosetta.rosetta.protocols.flxbb.
FilterStructs_TotalCharge
¶ Bases:
pyrosetta.rosetta.protocols.flxbb.FilterStructs
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apply
(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs_TotalCharge, : pyrosetta.rosetta.core.pose.Pose) → None¶ C++: protocols::flxbb::FilterStructs_TotalCharge::apply(const class core::pose::Pose &) –> void
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assign
(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs_TotalCharge, : pyrosetta.rosetta.protocols.flxbb.FilterStructs_TotalCharge) → pyrosetta.rosetta.protocols.flxbb.FilterStructs_TotalCharge¶ C++: protocols::flxbb::FilterStructs_TotalCharge::operator=(const class protocols::flxbb::FilterStructs_TotalCharge &) –> class protocols::flxbb::FilterStructs_TotalCharge &
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clone
(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs_TotalCharge) → pyrosetta.rosetta.protocols.flxbb.FilterStructs¶ C++: protocols::flxbb::FilterStructs_TotalCharge::clone() const –> class std::shared_ptr<class protocols::flxbb::FilterStructs>
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current_trial
(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs) → int¶ C++: protocols::flxbb::FilterStructs::current_trial() const –> unsigned long
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filter_on
(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs) → bool¶ C++: protocols::flxbb::FilterStructs::filter_on() const –> bool
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fresh_instance
(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs_TotalCharge) → pyrosetta.rosetta.protocols.flxbb.FilterStructs¶ C++: protocols::flxbb::FilterStructs_TotalCharge::fresh_instance() const –> class std::shared_ptr<class protocols::flxbb::FilterStructs>
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get_bestpose
(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs) → pyrosetta.rosetta.core.pose.Pose¶ C++: protocols::flxbb::FilterStructs::get_bestpose() const –> class std::shared_ptr<class core::pose::Pose>
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name
(*args, **kwargs)¶ Overloaded function.
- name(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs) -> str
C++: protocols::flxbb::FilterStructs::name() const –> std::string
- name(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs, name: str) -> None
C++: protocols::flxbb::FilterStructs::name(const class std::basic_string<char> &) –> void
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reset
(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs_TotalCharge, : pyrosetta.rosetta.core.pose.Pose) → None¶ C++: protocols::flxbb::FilterStructs_TotalCharge::reset(const class core::pose::Pose &) –> void
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set_ntrial
(self: pyrosetta.rosetta.protocols.flxbb.FilterStructs, ntrial: int) → None¶ C++: protocols::flxbb::FilterStructs::set_ntrial(const unsigned long) –> void
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class
pyrosetta.rosetta.protocols.flxbb.
FlxbbDesign
¶ Bases:
pyrosetta.rosetta.protocols.moves.Mover
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add_design_task
(self: pyrosetta.rosetta.protocols.flxbb.FlxbbDesign, design_task: pyrosetta.rosetta.protocols.flxbb.DesignTask) → None¶ add the design task which cotrols the iteration of fixbb design and relax
C++: protocols::flxbb::FlxbbDesign::add_design_task(const class std::shared_ptr<class protocols::flxbb::DesignTask>) –> void
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apply
(self: pyrosetta.rosetta.protocols.flxbb.FlxbbDesign, pose: pyrosetta.rosetta.core.pose.Pose) → None¶ mover apply
C++: protocols::flxbb::FlxbbDesign::apply(class core::pose::Pose &) –> void
-
assign
(self: pyrosetta.rosetta.protocols.flxbb.FlxbbDesign, : pyrosetta.rosetta.protocols.flxbb.FlxbbDesign) → pyrosetta.rosetta.protocols.flxbb.FlxbbDesign¶ C++: protocols::flxbb::FlxbbDesign::operator=(const class protocols::flxbb::FlxbbDesign &) –> class protocols::flxbb::FlxbbDesign &
-
clear_design_taskset
(self: pyrosetta.rosetta.protocols.flxbb.FlxbbDesign) → None¶ clear DesignTaskSet
C++: protocols::flxbb::FlxbbDesign::clear_design_taskset() –> void
-
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 applyC++: protocols::moves::Mover::clear_info() –> void
-
clone
(self: pyrosetta.rosetta.protocols.flxbb.FlxbbDesign) → pyrosetta.rosetta.protocols.moves.Mover¶ clone this object
C++: protocols::flxbb::FlxbbDesign::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>
-
fresh_instance
(self: pyrosetta.rosetta.protocols.flxbb.FlxbbDesign) → pyrosetta.rosetta.protocols.moves.Mover¶ create this type of object
C++: protocols::flxbb::FlxbbDesign::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.C++: protocols::moves::Mover::get_additional_output() –> class std::shared_ptr<class core::pose::Pose>
-
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_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_name
(self: pyrosetta.rosetta.protocols.flxbb.FlxbbDesign) → str¶ C++: protocols::flxbb::FlxbbDesign::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_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_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_std_allocator_std_string_t¶ non-const accessor
C++: protocols::moves::Mover::info() –> class std::list<std::string, class std::allocator<std::string > > &
-
initialize_filter
(self: pyrosetta.rosetta.protocols.flxbb.FlxbbDesign, filter_trial: int, filter_type: str) → None¶ initialize filter parameters
C++: protocols::flxbb::FlxbbDesign::initialize_filter(const unsigned long, const class std::basic_string<char> &) –> void
-
last_proposal_density_ratio
(self: pyrosetta.rosetta.protocols.moves.Mover) → float¶ C++: protocols::moves::Mover::last_proposal_density_ratio() –> double
-
movemap_from_blueprint
(self: pyrosetta.rosetta.protocols.flxbb.FlxbbDesign, value: bool) → None¶ set movemap for relax
C++: protocols::flxbb::FlxbbDesign::movemap_from_blueprint(const bool) –> void
-
mover_name
() → str¶ C++: protocols::flxbb::FlxbbDesign::mover_name() –> std::string
-
name
() → str¶ C++: protocols::moves::Mover::name() –> std::string
-
no_design
(self: pyrosetta.rosetta.protocols.flxbb.FlxbbDesign, no_design: bool) → None¶ design protocol will not be performed (default false)
C++: protocols::flxbb::FlxbbDesign::no_design(const bool) –> void
-
no_relax
(self: pyrosetta.rosetta.protocols.flxbb.FlxbbDesign, no_relax: bool) → None¶ relax is not performed after design (default false)
C++: protocols::flxbb::FlxbbDesign::no_relax(const bool) –> void
-
parse_my_tag
(self: pyrosetta.rosetta.protocols.flxbb.FlxbbDesign, tag: pyrosetta.rosetta.utility.tag.Tag, data: pyrosetta.rosetta.basic.datacache.DataMap, : pyrosetta.rosetta.std.map_std_string_std_shared_ptr_protocols_filters_Filter_t, : pyrosetta.rosetta.std.map_const_std_string_std_shared_ptr_protocols_moves_Mover_t, : pyrosetta.rosetta.core.pose.Pose) → None¶ C++: protocols::flxbb::FlxbbDesign::parse_my_tag(class std::shared_ptr<const class utility::tag::Tag>, class basic::datacache::DataMap &, const class std::map<class std::basic_string<char>, class std::shared_ptr<class protocols::filters::Filter>, struct std::less<class std::basic_string<char> >, class std::allocator<struct std::pair<const class std::basic_string<char>, class std::shared_ptr<class protocols::filters::Filter> > > > &, const class std::map<const class std::basic_string<char>, class std::shared_ptr<class protocols::moves::Mover>, struct std::less<const class std::basic_string<char> >, class std::allocator<struct std::pair<const class std::basic_string<char>, class std::shared_ptr<class protocols::moves::Mover> > > > &, const class core::pose::Pose &) –> void
-
provide_xml_schema
(xsd: pyrosetta.rosetta.utility.tag.XMLSchemaDefinition) → None¶ C++: protocols::flxbb::FlxbbDesign::provide_xml_schema(class utility::tag::XMLSchemaDefinition &) –> void
-
read_options
(self: pyrosetta.rosetta.protocols.flxbb.FlxbbDesign) → None¶ read parameters
C++: protocols::flxbb::FlxbbDesign::read_options() –> void
-
register_options
() → None¶ register options
C++: protocols::flxbb::FlxbbDesign::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_blueprint
(self: pyrosetta.rosetta.protocols.flxbb.FlxbbDesign, blueprint: protocols::parser::BluePrint) → None¶ set BluePrintOP
C++: protocols::flxbb::FlxbbDesign::set_blueprint(const class std::shared_ptr<class protocols::parser::BluePrint>) –> void
-
set_current_job
(self: pyrosetta.rosetta.protocols.moves.Mover, job: protocols::jobdist::BasicJob) → None¶ ////////////////////////////end Job Distributor interface////////////////////////////////////////
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 class std::basic_string<char> &) –> void
-
set_design_taskset
(self: pyrosetta.rosetta.protocols.flxbb.FlxbbDesign, design_taskset: pyrosetta.rosetta.utility.vector1_std_shared_ptr_protocols_flxbb_DesignTask_t) → None¶ - set DesignTaskSet
- Once you set DesignTaskSet, this controls almost every setups of this class
C++: protocols::flxbb::FlxbbDesign::set_design_taskset(const class utility::vector1<class std::shared_ptr<class protocols::flxbb::DesignTask>, class std::allocator<class std::shared_ptr<class protocols::flxbb::DesignTask> > > &) –> void
-
set_filter_during_design
(self: pyrosetta.rosetta.protocols.flxbb.FlxbbDesign, filter_during_design: pyrosetta.rosetta.protocols.flxbb.FilterStructs) → None¶ filtering during design
C++: protocols::flxbb::FlxbbDesign::set_filter_during_design(const class std::shared_ptr<class protocols::flxbb::FilterStructs>) –> 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_layer_mode
(self: pyrosetta.rosetta.protocols.flxbb.FlxbbDesign, layer_mode: str) → None¶ set layer mode
C++: protocols::flxbb::FlxbbDesign::set_layer_mode(const class std::basic_string<char> &) –> void
-
set_movemap
(self: pyrosetta.rosetta.protocols.flxbb.FlxbbDesign, movemap: pyrosetta.rosetta.core.kinematics.MoveMap) → None¶ set movemap for relax
C++: protocols::flxbb::FlxbbDesign::set_movemap(const class std::shared_ptr<class core::kinematics::MoveMap>) –> void
-
set_movemap_factory
(self: pyrosetta.rosetta.protocols.flxbb.FlxbbDesign, movemap_factory: pyrosetta.rosetta.core.select.movemap.MoveMapFactory) → None¶ set movemapi_factory for relax
C++: protocols::flxbb::FlxbbDesign::set_movemap_factory(class std::shared_ptr<const class core::select::movemap::MoveMapFactory>) –> 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_ncycles
(self: pyrosetta.rosetta.protocols.flxbb.FlxbbDesign, ncycles: int) → None¶ the number of cycles of fixbb and relax
C++: protocols::flxbb::FlxbbDesign::set_ncycles(const unsigned long) –> void
-
set_scorefxn_design
(self: pyrosetta.rosetta.protocols.flxbb.FlxbbDesign, scorefxn: pyrosetta.rosetta.core.scoring.ScoreFunction) → None¶ set the score function for fixbb design
C++: protocols::flxbb::FlxbbDesign::set_scorefxn_design(const class std::shared_ptr<class core::scoring::ScoreFunction>) –> void
-
set_scorefxn_relax
(self: pyrosetta.rosetta.protocols.flxbb.FlxbbDesign, scorefxn: pyrosetta.rosetta.core.scoring.ScoreFunction) → None¶ set the score function for relax
C++: protocols::flxbb::FlxbbDesign::set_scorefxn_relax(const class std::shared_ptr<class core::scoring::ScoreFunction>) –> void
-
set_type
(self: pyrosetta.rosetta.protocols.moves.Mover, setting: str) → None¶ C++: protocols::moves::Mover::set_type(const class std::basic_string<char> &) –> void
-
set_weight_constraints_NtoC
(self: pyrosetta.rosetta.protocols.flxbb.FlxbbDesign, value: float) → None¶ - set weight of constraints_NtoC which constrain between Ca atoms of C- and N-terminal
- if this weight > 0.0, the constraints is applied ( default = -1.0 )
C++: protocols::flxbb::FlxbbDesign::set_weight_constraints_NtoC(const double) –> void
-
set_weight_constraints_sheet
(self: pyrosetta.rosetta.protocols.flxbb.FlxbbDesign, value: float) → None¶ - set weight of constraints_sheet which constrains between Ca atoms in beta-sheets
- if this weight > 0.0, the constraints is applied ( default = -1.0 )
C++: protocols::flxbb::FlxbbDesign::set_weight_constraints_sheet(const double) –> void
-
show
(*args, **kwargs)¶ Overloaded function.
- show(self: pyrosetta.rosetta.protocols.moves.Mover) -> None
- show(self: pyrosetta.rosetta.protocols.moves.Mover, output: pyrosetta.rosetta.std.ostream) -> None
Outputs details about the Mover, including current settings.
C++: protocols::moves::Mover::show(class std::basic_ostream<char> &) 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) -> str
C++: protocols::moves::Mover::type() const –> const std::string &
- type(self: pyrosetta.rosetta.protocols.moves.Mover, type_in: str) -> None
C++: protocols::moves::Mover::type(const class std::basic_string<char> &) –> void
-
use_origseq_for_not_dsgned_layer
(self: pyrosetta.rosetta.protocols.flxbb.FlxbbDesign, use: bool) → None¶ - use original sequence for not designed region in layer_mode,
- otherwise the residues of the region turned into Ala ( default true )
C++: protocols::flxbb::FlxbbDesign::use_origseq_for_not_dsgned_layer(const bool) –> void
-
-
class
pyrosetta.rosetta.protocols.flxbb.
FlxbbDesignPack
¶ Bases:
pyrosetta.rosetta.protocols.minimization_packing.PackRotamersMover
-
apply
(self: pyrosetta.rosetta.protocols.flxbb.FlxbbDesignPack, pose: pyrosetta.rosetta.core.pose.Pose) → None¶ C++: protocols::flxbb::FlxbbDesignPack::apply(class core::pose::Pose &) –> void
-
assign
(self: pyrosetta.rosetta.protocols.flxbb.FlxbbDesignPack, : pyrosetta.rosetta.protocols.flxbb.FlxbbDesignPack) → pyrosetta.rosetta.protocols.flxbb.FlxbbDesignPack¶ C++: protocols::flxbb::FlxbbDesignPack::operator=(const class protocols::flxbb::FlxbbDesignPack &) –> class protocols::flxbb::FlxbbDesignPack &
-
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 applyC++: protocols::moves::Mover::clear_info() –> void
-
clone
(self: pyrosetta.rosetta.protocols.minimization_packing.PackRotamersMover) → pyrosetta.rosetta.protocols.moves.Mover¶ required in the context of the parser/scripting scheme
C++: protocols::minimization_packing::PackRotamersMover::clone() const –> class std::shared_ptr<class protocols::moves::Mover>
-
complex_type_generator_for_pack_rotamers_mover
(xsd: pyrosetta.rosetta.utility.tag.XMLSchemaDefinition) → pyrosetta.rosetta.utility.tag.XMLSchemaComplexTypeGenerator¶ C++: protocols::minimization_packing::PackRotamersMover::complex_type_generator_for_pack_rotamers_mover(class utility::tag::XMLSchemaDefinition &) –> class std::shared_ptr<class utility::tag::XMLSchemaComplexTypeGenerator>
-
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>
-
fresh_instance
(self: pyrosetta.rosetta.protocols.minimization_packing.PackRotamersMover) → pyrosetta.rosetta.protocols.moves.Mover¶ required in the context of the parser/scripting scheme
C++: protocols::minimization_packing::PackRotamersMover::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.C++: protocols::moves::Mover::get_additional_output() –> class std::shared_ptr<class core::pose::Pose>
-
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_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_name
(self: pyrosetta.rosetta.protocols.flxbb.FlxbbDesignPack) → str¶ C++: protocols::flxbb::FlxbbDesignPack::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_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_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_std_allocator_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
-
mover_name
() → str¶ C++: protocols::minimization_packing::PackRotamersMover::mover_name() –> std::string
-
name
() → str¶ C++: protocols::moves::Mover::name() –> std::string
-
nloop
(*args, **kwargs)¶ Overloaded function.
- nloop(self: pyrosetta.rosetta.protocols.minimization_packing.PackRotamersMover, nloop_in: int) -> None
C++: protocols::minimization_packing::PackRotamersMover::nloop(unsigned long) –> void
- nloop(self: pyrosetta.rosetta.protocols.minimization_packing.PackRotamersMover) -> int
C++: protocols::minimization_packing::PackRotamersMover::nloop() const –> unsigned long
-
parse_my_tag
(self: pyrosetta.rosetta.protocols.minimization_packing.PackRotamersMover, : pyrosetta.rosetta.utility.tag.Tag, : pyrosetta.rosetta.basic.datacache.DataMap, : pyrosetta.rosetta.std.map_std_string_std_shared_ptr_protocols_filters_Filter_t, : pyrosetta.rosetta.std.map_const_std_string_std_shared_ptr_protocols_moves_Mover_t, : pyrosetta.rosetta.core.pose.Pose) → None¶ parse XML (specifically in the context of the parser/scripting scheme)
C++: protocols::minimization_packing::PackRotamersMover::parse_my_tag(class std::shared_ptr<const class utility::tag::Tag>, class basic::datacache::DataMap &, const class std::map<class std::basic_string<char>, class std::shared_ptr<class protocols::filters::Filter>, struct std::less<class std::basic_string<char> >, class std::allocator<struct std::pair<const class std::basic_string<char>, class std::shared_ptr<class protocols::filters::Filter> > > > &, const class std::map<const class std::basic_string<char>, class std::shared_ptr<class protocols::moves::Mover>, struct std::less<const class std::basic_string<char> >, class std::allocator<struct std::pair<const class std::basic_string<char>, class std::shared_ptr<class protocols::moves::Mover> > > > &, const class core::pose::Pose &) –> void
-
parse_score_function
(self: pyrosetta.rosetta.protocols.minimization_packing.PackRotamersMover, : pyrosetta.rosetta.utility.tag.Tag, : pyrosetta.rosetta.basic.datacache.DataMap, : pyrosetta.rosetta.std.map_std_string_std_shared_ptr_protocols_filters_Filter_t, : pyrosetta.rosetta.std.map_const_std_string_std_shared_ptr_protocols_moves_Mover_t, : pyrosetta.rosetta.core.pose.Pose) → None¶ parse “scorefxn” XML option (can be employed virtually by derived Packing movers)
C++: protocols::minimization_packing::PackRotamersMover::parse_score_function(class std::shared_ptr<const class utility::tag::Tag>, const class basic::datacache::DataMap &, const class std::map<class std::basic_string<char>, class std::shared_ptr<class protocols::filters::Filter>, struct std::less<class std::basic_string<char> >, class std::allocator<struct std::pair<const class std::basic_string<char>, class std::shared_ptr<class protocols::filters::Filter> > > > &, const class std::map<const class std::basic_string<char>, class std::shared_ptr<class protocols::moves::Mover>, struct std::less<const class std::basic_string<char> >, class std::allocator<struct std::pair<const class std::basic_string<char>, class std::shared_ptr<class protocols::moves::Mover> > > > &, const class core::pose::Pose &) –> void
-
parse_task_operations
(self: pyrosetta.rosetta.protocols.minimization_packing.PackRotamersMover, : pyrosetta.rosetta.utility.tag.Tag, : pyrosetta.rosetta.basic.datacache.DataMap, : pyrosetta.rosetta.std.map_std_string_std_shared_ptr_protocols_filters_Filter_t, : pyrosetta.rosetta.std.map_const_std_string_std_shared_ptr_protocols_moves_Mover_t, : pyrosetta.rosetta.core.pose.Pose) → None¶ parse “task_operations” XML option (can be employed virtually by derived Packing movers)
C++: protocols::minimization_packing::PackRotamersMover::parse_task_operations(class std::shared_ptr<const class utility::tag::Tag>, const class basic::datacache::DataMap &, const class std::map<class std::basic_string<char>, class std::shared_ptr<class protocols::filters::Filter>, struct std::less<class std::basic_string<char> >, class std::allocator<struct std::pair<const class std::basic_string<char>, class std::shared_ptr<class protocols::filters::Filter> > > > &, const class std::map<const class std::basic_string<char>, class std::shared_ptr<class protocols::moves::Mover>, struct std::less<const class std::basic_string<char> >, class std::allocator<struct std::pair<const class std::basic_string<char>, class std::shared_ptr<class protocols::moves::Mover> > > > &, const class core::pose::Pose &) –> void
-
provide_xml_schema
(xsd: pyrosetta.rosetta.utility.tag.XMLSchemaDefinition) → None¶ C++: protocols::minimization_packing::PackRotamersMover::provide_xml_schema(class utility::tag::XMLSchemaDefinition &) –> void
-
register_options
() → None¶ Overload this static method if you access options within the mover.
These options will end up in -help of your application if users of this mover call register_options. Do this recursively! If you use movers within your mover, call their register_options in your register_options() method.C++: protocols::moves::Mover::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
-
rotamer_sets
(self: pyrosetta.rosetta.protocols.minimization_packing.PackRotamersMover) → pyrosetta.rosetta.core.pack.rotamer_set.RotamerSets¶ Returns the RotamerSets object being used for packing
- This is only valid after a call to setup or apply.
C++: protocols::minimization_packing::PackRotamersMover::rotamer_sets() const –> class std::shared_ptr<const class core::pack::rotamer_set::RotamerSets>
-
score_function
(*args, **kwargs)¶ Overloaded function.
- score_function(self: pyrosetta.rosetta.protocols.minimization_packing.PackRotamersMover, sf: pyrosetta.rosetta.core.scoring.ScoreFunction) -> None
Sets the ScoreFunction to <sf>
- example(s):
- packmover.score_function(scorefxn)
- See Also:
- PackRotamersMover PackRotamersMover.task
C++: protocols::minimization_packing::PackRotamersMover::score_function(class std::shared_ptr<const class core::scoring::ScoreFunction>) –> void
- score_function(self: pyrosetta.rosetta.protocols.minimization_packing.PackRotamersMover) -> pyrosetta.rosetta.core.scoring.ScoreFunction
Returns the ScoreFunction
- example(s):
- packmover.score_function()
- See Also:
- PackRotamersMover PackRotamersMover.task
C++: protocols::minimization_packing::PackRotamersMover::score_function() const –> class std::shared_ptr<const class core::scoring::ScoreFunction>
-
set_current_job
(self: pyrosetta.rosetta.protocols.moves.Mover, job: protocols::jobdist::BasicJob) → None¶ ////////////////////////////end Job Distributor interface////////////////////////////////////////
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 class std::basic_string<char> &) –> 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_type
(self: pyrosetta.rosetta.protocols.moves.Mover, setting: str) → None¶ C++: protocols::moves::Mover::set_type(const class std::basic_string<char> &) –> void
-
show
(*args, **kwargs)¶ Overloaded function.
- show(self: pyrosetta.rosetta.protocols.minimization_packing.PackRotamersMover) -> None
- show(self: pyrosetta.rosetta.protocols.minimization_packing.PackRotamersMover, output: pyrosetta.rosetta.std.ostream) -> None
C++: protocols::minimization_packing::PackRotamersMover::show(class std::basic_ostream<char> &) const –> void
-
task
(*args, **kwargs)¶ Overloaded function.
- task(self: pyrosetta.rosetta.protocols.minimization_packing.PackRotamersMover, t: pyrosetta.rosetta.core.pack.task.PackerTask) -> None
Sets the PackerTask to <t>
- example(s):
- packmover.task(task_pack)
- See Also:
- PackRotamersMover PackRotamersMover.task_factory
C++: protocols::minimization_packing::PackRotamersMover::task(class std::shared_ptr<const class core::pack::task::PackerTask>) –> void
- task(self: pyrosetta.rosetta.protocols.minimization_packing.PackRotamersMover) -> pyrosetta.rosetta.core.pack.task.PackerTask
Returns the PackerTask
- example(s):
- packmover.task()
- See Also:
- PackRotamersMover PackRotamersMover.task_factory
C++: protocols::minimization_packing::PackRotamersMover::task() const –> class std::shared_ptr<const class core::pack::task::PackerTask>
-
task_factory
(*args, **kwargs)¶ Overloaded function.
- task_factory(self: pyrosetta.rosetta.protocols.minimization_packing.PackRotamersMover, tf: pyrosetta.rosetta.core.pack.task.TaskFactory) -> None
Sets the TaskFactory to <tf>
- example(s):
- packmover.task_factory(task_design)
- See Also:
- PackRotamersMover PackRotamersMover.task
C++: protocols::minimization_packing::PackRotamersMover::task_factory(class std::shared_ptr<const class core::pack::task::TaskFactory>) –> void
- task_factory(self: pyrosetta.rosetta.protocols.minimization_packing.PackRotamersMover) -> pyrosetta.rosetta.core.pack.task.TaskFactory
Returns the TaskFactory
- example(s):
- packmover.task_factory()
- See Also:
- PackRotamersMover PackRotamersMover.task
C++: protocols::minimization_packing::PackRotamersMover::task_factory() const –> class std::shared_ptr<const class core::pack::task::TaskFactory>
-
task_is_valid
(self: pyrosetta.rosetta.protocols.minimization_packing.PackRotamersMover, pose: pyrosetta.rosetta.core.pose.Pose) → bool¶ C++: protocols::minimization_packing::PackRotamersMover::task_is_valid(const class core::pose::Pose &) const –> bool
-
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) -> str
C++: protocols::moves::Mover::type() const –> const std::string &
- type(self: pyrosetta.rosetta.protocols.moves.Mover, type_in: str) -> None
C++: protocols::moves::Mover::type(const class std::basic_string<char> &) –> void
-
-
pyrosetta.rosetta.protocols.flxbb.
FlxbbDesign_main
() → None¶ C++: protocols::flxbb::FlxbbDesign_main() –> void
-
class
pyrosetta.rosetta.protocols.flxbb.
InterlockAroma
¶ Bases:
pyrosetta.rosetta.protocols.moves.Mover
-
apply
(self: pyrosetta.rosetta.protocols.flxbb.InterlockAroma, pose: pyrosetta.rosetta.core.pose.Pose) → None¶ mover apply
C++: protocols::flxbb::InterlockAroma::apply(class core::pose::Pose &) –> void
-
assign
(self: pyrosetta.rosetta.protocols.flxbb.InterlockAroma, : pyrosetta.rosetta.protocols.flxbb.InterlockAroma) → pyrosetta.rosetta.protocols.flxbb.InterlockAroma¶ C++: protocols::flxbb::InterlockAroma::operator=(const class protocols::flxbb::InterlockAroma &) –> class protocols::flxbb::InterlockAroma &
-
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 applyC++: protocols::moves::Mover::clear_info() –> void
-
clone
(self: pyrosetta.rosetta.protocols.flxbb.InterlockAroma) → pyrosetta.rosetta.protocols.moves.Mover¶ clone this object
C++: protocols::flxbb::InterlockAroma::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>
-
fresh_instance
(self: pyrosetta.rosetta.protocols.flxbb.InterlockAroma) → pyrosetta.rosetta.protocols.moves.Mover¶ create this type of object
C++: protocols::flxbb::InterlockAroma::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.C++: protocols::moves::Mover::get_additional_output() –> class std::shared_ptr<class core::pose::Pose>
-
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_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_name
(self: pyrosetta.rosetta.protocols.flxbb.InterlockAroma) → str¶ C++: protocols::flxbb::InterlockAroma::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_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_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_std_allocator_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
-
mover_name
() → str¶ C++: protocols::flxbb::InterlockAroma::mover_name() –> std::string
-
name
() → str¶ C++: protocols::moves::Mover::name() –> std::string
-
parse_my_tag
(self: pyrosetta.rosetta.protocols.flxbb.InterlockAroma, tag: pyrosetta.rosetta.utility.tag.Tag, data: pyrosetta.rosetta.basic.datacache.DataMap, : pyrosetta.rosetta.std.map_std_string_std_shared_ptr_protocols_filters_Filter_t, : pyrosetta.rosetta.std.map_const_std_string_std_shared_ptr_protocols_moves_Mover_t, : pyrosetta.rosetta.core.pose.Pose) → None¶ C++: protocols::flxbb::InterlockAroma::parse_my_tag(class std::shared_ptr<const class utility::tag::Tag>, class basic::datacache::DataMap &, const class std::map<class std::basic_string<char>, class std::shared_ptr<class protocols::filters::Filter>, struct std::less<class std::basic_string<char> >, class std::allocator<struct std::pair<const class std::basic_string<char>, class std::shared_ptr<class protocols::filters::Filter> > > > &, const class std::map<const class std::basic_string<char>, class std::shared_ptr<class protocols::moves::Mover>, struct std::less<const class std::basic_string<char> >, class std::allocator<struct std::pair<const class std::basic_string<char>, class std::shared_ptr<class protocols::moves::Mover> > > > &, const class core::pose::Pose &) –> void
-
provide_xml_schema
(xsd: pyrosetta.rosetta.utility.tag.XMLSchemaDefinition) → None¶ C++: protocols::flxbb::InterlockAroma::provide_xml_schema(class utility::tag::XMLSchemaDefinition &) –> void
-
register_options
() → None¶ Overload this static method if you access options within the mover.
These options will end up in -help of your application if users of this mover call register_options. Do this recursively! If you use movers within your mover, call their register_options in your register_options() method.C++: protocols::moves::Mover::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¶ ////////////////////////////end Job Distributor interface////////////////////////////////////////
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 class std::basic_string<char> &) –> 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_type
(self: pyrosetta.rosetta.protocols.moves.Mover, setting: str) → None¶ C++: protocols::moves::Mover::set_type(const class std::basic_string<char> &) –> void
-
show
(*args, **kwargs)¶ Overloaded function.
- show(self: pyrosetta.rosetta.protocols.moves.Mover) -> None
- show(self: pyrosetta.rosetta.protocols.moves.Mover, output: pyrosetta.rosetta.std.ostream) -> None
Outputs details about the Mover, including current settings.
C++: protocols::moves::Mover::show(class std::basic_ostream<char> &) 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) -> str
C++: protocols::moves::Mover::type() const –> const std::string &
- type(self: pyrosetta.rosetta.protocols.moves.Mover, type_in: str) -> None
C++: protocols::moves::Mover::type(const class std::basic_string<char> &) –> void
-
-
pyrosetta.rosetta.protocols.flxbb.
constraints_NtoC
(*args, **kwargs)¶ Overloaded function.
- constraints_NtoC(pose: pyrosetta.rosetta.core.pose.Pose, coef: float) -> pyrosetta.rosetta.utility.vector1_std_shared_ptr_core_scoring_constraints_Constraint_t
- constraints_NtoC(pose: pyrosetta.rosetta.core.pose.Pose, coef: float, condist: float) -> pyrosetta.rosetta.utility.vector1_std_shared_ptr_core_scoring_constraints_Constraint_t
constraint between N- and C-terminal Ca atoms
C++: protocols::flxbb::constraints_NtoC(const class core::pose::Pose &, const double, const double) –> class utility::vector1<class std::shared_ptr<class core::scoring::constraints::Constraint>, class std::allocator<class std::shared_ptr<class core::scoring::constraints::Constraint> > >
-
pyrosetta.rosetta.protocols.flxbb.
constraints_sheet
(*args, **kwargs)¶ Overloaded function.
- constraints_sheet(pose: pyrosetta.rosetta.core.pose.Pose, blue: protocols::parser::BluePrint, coef: float) -> pyrosetta.rosetta.utility.vector1_std_shared_ptr_core_scoring_constraints_Constraint_t
- constraints_sheet(pose: pyrosetta.rosetta.core.pose.Pose, blue: protocols::parser::BluePrint, coef: float, condist: float) -> pyrosetta.rosetta.utility.vector1_std_shared_ptr_core_scoring_constraints_Constraint_t
constrain between Ca atoms in beta sheet, which are specified in blueprint file
C++: protocols::flxbb::constraints_sheet(const class core::pose::Pose &, const class std::shared_ptr<class protocols::parser::BluePrint> &, const double, const double) –> class utility::vector1<class std::shared_ptr<class core::scoring::constraints::Constraint>, class std::allocator<class std::shared_ptr<class core::scoring::constraints::Constraint> > >
- constraints_sheet(pose: pyrosetta.rosetta.core.pose.Pose, coef: float) -> pyrosetta.rosetta.utility.vector1_std_shared_ptr_core_scoring_constraints_Constraint_t
- constraints_sheet(pose: pyrosetta.rosetta.core.pose.Pose, coef: float, condist: float) -> pyrosetta.rosetta.utility.vector1_std_shared_ptr_core_scoring_constraints_Constraint_t
constrain between Ca atoms in beta sheet
C++: protocols::flxbb::constraints_sheet(const class core::pose::Pose &, const double, const double) –> class utility::vector1<class std::shared_ptr<class core::scoring::constraints::Constraint>, class std::allocator<class std::shared_ptr<class core::scoring::constraints::Constraint> > >
-
pyrosetta.rosetta.protocols.flxbb.
find_ligands
(pose: pyrosetta.rosetta.core.pose.Pose) → pyrosetta.rosetta.utility.vector1_unsigned_long¶ Looks for unknown amino acids in the pose and returns their indices
C++: protocols::flxbb::find_ligands(const class core::pose::Pose &) –> class utility::vector1<unsigned long, class std::allocator<unsigned long> >