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Rosetta Protocols
2014.16.56682
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#include <RDC_Evaluator.hh>
Public Member Functions | |
| SelectRDC_Evaluator (core::scoring::ResidueSelection const &selection, std::string tag="", std::string file="") | |
| SelectRDC_Evaluator (utility::vector1< core::Size > const &selection, std::string tag="", std::string file="") | |
| SelectRDC_Evaluator (core::pose::PoseCOP, std::string tag="") | |
| SelectRDC_Evaluator (core::pose::Pose const &, std::string tag="") | |
| virtual core::Real | apply (core::pose::Pose &) const |
| evaluate pose More... | |
Public Member Functions inherited from protocols::evaluation::SingleValuePoseEvaluator< core::Real > | |
| SingleValuePoseEvaluator (std::string name) | |
| virtual void | apply (core::pose::Pose &, std::string tag, core::io::silent::SilentStruct &pss) const |
| evaluate pose and store values in Silent_Struct why is this specific to a specific type of SilentStruct? that seems needlessly pointless and overly constraining. More... | |
| virtual bool | applicable (core::pose::Pose const &) const |
| virtual core::Size | size () const |
| virtual std::string | name (core::Size) const |
Public Member Functions inherited from protocols::evaluation::PoseEvaluator | |
| PoseEvaluator () | |
| virtual | ~PoseEvaluator () |
| virtual void | apply (core::io::silent::SilentStruct &pss) const |
| direct application to SilentStruct... default implementation makes pose and calls "apply", you can overload if you don't need the pose-step More... | |
Private Member Functions | |
| void | init_rdcs () |
Private Attributes | |
| core::scoring::ResidueSelection | selection_ |
| std::string | tag_ |
| core::scoring::ResidualDipolarCouplingOP | rdc_data_ |
| std::string | rdc_file_ |
| protocols::simple_filters::SelectRDC_Evaluator::SelectRDC_Evaluator | ( | core::scoring::ResidueSelection const & | selection, |
| std::string | tag = "", |
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| std::string | file = "" |
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| ) |
| protocols::simple_filters::SelectRDC_Evaluator::SelectRDC_Evaluator | ( | utility::vector1< core::Size > const & | selection, |
| std::string | tag = "", |
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| std::string | file = "" |
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| ) |
References evaluation, init_rdcs(), and selection_.
| protocols::simple_filters::SelectRDC_Evaluator::SelectRDC_Evaluator | ( | core::pose::PoseCOP | pose, |
| std::string | tag = "" |
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| ) |
References evaluation, protocols::evaluation::find_existing_residues(), init_rdcs(), and selection_.
| protocols::simple_filters::SelectRDC_Evaluator::SelectRDC_Evaluator | ( | core::pose::Pose const & | pose, |
| std::string | tag = "" |
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| ) |
References evaluation, protocols::evaluation::find_existing_residues(), init_rdcs(), and selection_.
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virtual |
evaluate pose
Implements protocols::evaluation::SingleValuePoseEvaluator< core::Real >.
References protocols::simple_filters::energy_evaluator, core::scoring::methods::ResidualDipolarCouplingEnergy::eval_dipolar(), and rdc_data_.
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private |
References core::scoring::ResidualDipolarCoupling::get_RDC_data(), rdc_data_, rdc_file_, scoring, and selection_.
Referenced by SelectRDC_Evaluator().
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private |
Referenced by apply(), and init_rdcs().
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private |
Referenced by init_rdcs().
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private |
Referenced by init_rdcs(), and SelectRDC_Evaluator().
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private |
1.8.7