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protocols::scoring::methods::pcs::TensorsOptimizer Class Reference

#include <TensorsOptimizer.hh>

Inheritance diagram for protocols::scoring::methods::pcs::TensorsOptimizer:
Inheritance graph
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Public Member Functions

 TensorsOptimizer (PCS_data const &pcs_d)
 
 ~TensorsOptimizer () override
 
core::Real operator() (core::optimization::Multivec const &vars) const override
 
void dfunc (core::optimization::Multivec const &vars, core::optimization::Multivec &dE_dvars) const override
 OptE dfunc. More...
 
- Public Member Functions inherited from core::optimization::Multifunc
 ~Multifunc () override=default
 Destructor. More...
 
virtual bool abort_min (Multivec const &) const
 Christophe added the following to allow premature end of minimization If you want to abort the minimizer under specific circonstances overload this function and return true if you want to stop, false if you want to continue. FOR THE MOMENT, ONLY IN DFPMIN! More...
 
virtual void dump (Multivec const &, Multivec const &) const
 Error state reached – derivative does not match gradient Derived classes have the oportunity to now output and or analyze the two vars assignments vars, vars+delta where the derivatives are incorrect. More...
 

Public Attributes

PCS_data const & pcs_d_
 

Private Member Functions

 TensorsOptimizer ()
 No default constructor: You must provide a PCS_data object when constructing. More...
 

Additional Inherited Members

- Public Types inherited from core::optimization::Multifunc
typedef utility::VirtualBase parent
 
- Protected Member Functions inherited from core::optimization::Multifunc
 Multifunc ()
 Default constructor. More...
 
 Multifunc (Multifunc const &)
 Copy constructor. More...
 
Multifuncoperator= (Multifunc const &)
 Copy assignment. More...
 

Constructor & Destructor Documentation

protocols::scoring::methods::pcs::TensorsOptimizer::TensorsOptimizer ( )
private

No default constructor: You must provide a PCS_data object when constructing.

protocols::scoring::methods::pcs::TensorsOptimizer::TensorsOptimizer ( PCS_data const &  pcs_d)
protocols::scoring::methods::pcs::TensorsOptimizer::~TensorsOptimizer ( )
overridedefault

Member Function Documentation

void protocols::scoring::methods::pcs::TensorsOptimizer::dfunc ( core::optimization::Multivec const &  vars,
core::optimization::Multivec dE_dvars 
) const
overridevirtual
core::Real protocols::scoring::methods::pcs::TensorsOptimizer::operator() ( core::optimization::Multivec const &  vars) const
overridevirtual

Member Data Documentation

PCS_data const& protocols::scoring::methods::pcs::TensorsOptimizer::pcs_d_

Referenced by dfunc(), and operator()().


The documentation for this class was generated from the following files: