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Rosetta
2021.16
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#include <TaskAwareSASAFilter.hh>

Public Types | |
| typedef protocols::filters::Filter | Super |
| typedef protocols::filters::Filter | Filter |
| typedef protocols::filters::FilterOP | FilterOP |
| typedef core::Real | Real |
| typedef core::pose::Pose | Pose |
| typedef utility::tag::TagCOP | TagCOP |
| typedef basic::datacache::DataMap | DataMap |
Public Member Functions | |
| TaskAwareSASAFilter () | |
| TaskAwareSASAFilter (core::pack::task::TaskFactoryOP task_factory, core::Real const t, bool const d, bool const s, core::Real const r, core::Size const j) | |
| TaskAwareSASAFilter (TaskAwareSASAFilter const &rval) | |
| ~TaskAwareSASAFilter () override | |
| protocols::filters::FilterOP | clone () const override |
| protocols::filters::FilterOP | fresh_instance () const override |
| void | task_factory (core::pack::task::TaskFactoryOP task_factory) |
| void | threshold (core::Real const t) |
| void | designable_only (bool const d) |
| void | sc_only (bool const s) |
| void | probe_radius (core::Real const r) |
| void | jump_id (core::Size const j) |
| core::pack::task::TaskFactoryOP | task_factory () const |
| core::Real | threshold () const |
| bool | designable_only () const |
| bool | sc_only () const |
| core::Real | probe_radius () const |
| core::Size | jump_id () const |
| void | parse_my_tag (TagCOP tag, basic::datacache::DataMap &) override |
| parse xml More... | |
| bool | apply (core::pose::Pose const &pose) const override |
| Returns true if the given pose passes the filter, false otherwise. More... | |
| core::Real | report_sm (core::pose::Pose const &pose) const override |
| used to report filter internals through a score or silent file More... | |
| void | report (std::ostream &out, core::pose::Pose const &pose) const override |
| core::Real | compute (core::pose::Pose const &pose, bool const verbose) const |
| calc oligomeric AverageDegree More... | |
| std::string | name () const override |
Public Member Functions inherited from protocols::filters::Filter | |
| Filter () | |
| Filter (std::string const &) | |
| Filter (Filter const &) | |
| ~Filter () override | |
| virtual std::string | get_type () const |
| std::string | get_user_defined_name () const |
| void | set_user_defined_name (std::string const &name) |
| virtual void | clear () |
| used to clear internal variables if needed. Using fresh_instance is preferred since it's a pure virtual More... | |
| virtual core::Real | score (core::pose::Pose &pose) |
| virtual void | provide_citation_info (basic::citation_manager::CitationCollectionList &) const |
| Provide citations to the passed CitationCollectionList Subclasses should add the info for themselves and any other classes they use. More... | |
Static Public Member Functions | |
| static std::string | class_name () |
| static void | provide_xml_schema (utility::tag::XMLSchemaDefinition &xsd) |
Private Attributes | |
| core::pack::task::TaskFactoryOP | task_factory_ |
| core::Real | threshold_ |
| bool | designable_only_ |
| bool | sc_only_ |
| core::Real | probe_radius_ |
| core::Size | jump_id_ |
Additional Inherited Members | |
Protected Attributes inherited from protocols::filters::Filter | |
| std::string | scorename_ |
| typedef basic::datacache::DataMap protocols::simple_filters::TaskAwareSASAFilter::DataMap |
| typedef utility::tag::TagCOP protocols::simple_filters::TaskAwareSASAFilter::TagCOP |
| protocols::simple_filters::TaskAwareSASAFilter::TaskAwareSASAFilter | ( | ) |
| protocols::simple_filters::TaskAwareSASAFilter::TaskAwareSASAFilter | ( | core::pack::task::TaskFactoryOP | task_factory, |
| core::Real const | t, | ||
| bool const | d, | ||
| bool const | s, | ||
| core::Real const | r, | ||
| core::Size const | j | ||
| ) |
|
default |
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overridedefault |
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overridevirtual |
Returns true if the given pose passes the filter, false otherwise.
Implements protocols::filters::Filter.
References compute(), and threshold().
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static |
Referenced by protocols::simple_filters::TaskAwareSASAFilterCreator::keyname(), name(), and provide_xml_schema().
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overridevirtual |
Implements protocols::filters::Filter.
| core::Real protocols::simple_filters::TaskAwareSASAFilter::compute | ( | core::pose::Pose const & | pose, |
| bool const | verbose | ||
| ) | const |
calc oligomeric AverageDegree
References core::scoring::calc_per_atom_sasa(), designable_only(), core::pose::Pose::dump_pdb(), core::pose::symmetry::get_sym_aware_jump_num(), core::pose::initialize_atomid_map(), jump_id(), core::conformation::Residue::name3(), core::conformation::Residue::nheavyatoms(), probe_radius(), core::pose::Pose::residue(), sc_only(), core::pose::Pose::size(), task_factory(), protocols::simple_filters::TR(), and protocols::toolbox::rigid_body::translate().
Referenced by apply(), report(), and report_sm().
| void protocols::simple_filters::TaskAwareSASAFilter::designable_only | ( | bool const | d | ) |
References designable_only_.
| bool protocols::simple_filters::TaskAwareSASAFilter::designable_only | ( | ) | const |
References designable_only_.
Referenced by compute(), and parse_my_tag().
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overridevirtual |
Implements protocols::filters::Filter.
| void protocols::simple_filters::TaskAwareSASAFilter::jump_id | ( | core::Size const | j | ) |
References jump_id_.
| core::Size protocols::simple_filters::TaskAwareSASAFilter::jump_id | ( | ) | const |
References jump_id_.
Referenced by compute(), and parse_my_tag().
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overridevirtual |
Reimplemented from protocols::filters::Filter.
References class_name().
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overridevirtual |
parse xml
Reimplemented from protocols::filters::Filter.
References designable_only(), jump_id(), core::pack::task::parse_task_operations(), probe_radius(), sc_only(), task_factory(), and threshold().
| void protocols::simple_filters::TaskAwareSASAFilter::probe_radius | ( | core::Real const | r | ) |
References probe_radius_.
| core::Real protocols::simple_filters::TaskAwareSASAFilter::probe_radius | ( | ) | const |
References probe_radius_.
Referenced by compute(), and parse_my_tag().
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static |
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overridevirtual |
Reimplemented from protocols::filters::Filter.
References compute().
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overridevirtual |
used to report filter internals through a score or silent file
Reimplemented from protocols::filters::Filter.
References compute().
| bool protocols::simple_filters::TaskAwareSASAFilter::sc_only | ( | ) | const |
References sc_only_.
Referenced by compute(), and parse_my_tag().
| void protocols::simple_filters::TaskAwareSASAFilter::task_factory | ( | core::pack::task::TaskFactoryOP | task_factory | ) |
References task_factory(), and task_factory_.
| core::pack::task::TaskFactoryOP protocols::simple_filters::TaskAwareSASAFilter::task_factory | ( | ) | const |
References task_factory_.
Referenced by compute(), parse_my_tag(), and task_factory().
| void protocols::simple_filters::TaskAwareSASAFilter::threshold | ( | core::Real const | t | ) |
References protocols::hybridization::t, and threshold_.
| core::Real protocols::simple_filters::TaskAwareSASAFilter::threshold | ( | ) | const |
References threshold_.
Referenced by apply(), and parse_my_tag().
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private |
Referenced by designable_only().
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private |
Referenced by jump_id().
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private |
Referenced by probe_radius().
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private |
Referenced by task_factory().
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private |
Referenced by threshold().
1.8.7