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Rosetta
2021.16
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Function that allows return of arbitrary FArrays – this time circularized. More...
#include <CircularGeneral1D_Func.hh>

Public Member Functions | |
| CircularGeneral1D_Func (ObjexxFCL::FArray1D< core::Real > const &data, core::Real const &xmin, core::Real const &xbin) | |
| CircularGeneral1D_Func (std::string const &filename) | |
| FuncOP | clone () const override |
| This method must return a deep copy of this Func, meaning if this Func holds pointers to other Func objects, that it must clone those Func objects as well. More... | |
| bool | operator== (Func const &other) const override |
| Equality operator. Looks for strict equality. Floating-point comparison is the rule rather than the exception. More... | |
| bool | same_type_as_me (Func const &other) const override |
| Does the input Func, "other", have the same type as me? Necessary for the equality operator to function correctly. All derived Func classes must implement this function. More... | |
| Real | func (Real const x) const override |
| Returns a value representing this function evaluated at a given point. More... | |
| Real | dfunc (Real const x) const override |
| Returns a value representing the derivative of this function evaluated at a given point. More... | |
Public Member Functions inherited from core::scoring::func::Func | |
| ~Func () override | |
| Automatically generated virtual destructor for class deriving directly from VirtualBase. More... | |
| bool | operator!= (Func const &other) const |
| inequality operator – simply the negation of the (virtual) equality operator More... | |
| virtual void | read_data (std::istream &) |
| initialize this Func from the given std::istream. More... | |
| virtual Real | estimate_dfunc (Real const r) const |
| Estimates the derivative of this function at a given radius by calculating the slope of the secant line from func(r) and func(r+1e-05). More... | |
| virtual Real | estimate_dfunc (Real const r, Real const h) const |
| Estimates the derivative of this function at a given radius by calculating the slope of the secant line from func(r) and func(r+h). More... | |
| virtual void | show (std::ostream &out) const |
| Prints out space-delimited columns for r, func, dfunc and dfunc_est. The values for func, dfunc and dfunc_est are plotted as a function of r, which is varied from 2-20 in steps of 0.5. The value for dfunc_est is the estimated by the method estimate_dfunc( r ). More... | |
| virtual void | show_definition (std::ostream &out) const |
| shows the definition of this function, usually the string type of function and the parameters passed in to the constructor. More... | |
| virtual Size | show_violations (std::ostream &out, Real r, Size verbose_level, Real threshold=1) const |
| show some sort of stringified representation of the violations for this constraint. More... | |
Private Attributes | |
| ObjexxFCL::FArray1D< core::Real > | data_ |
| Real | xmin_ |
| Real | xbin_ |
| Size | num_bins_ |
Function that allows return of arbitrary FArrays – this time circularized.
| core::scoring::func::CircularGeneral1D_Func::CircularGeneral1D_Func | ( | ObjexxFCL::FArray1D< core::Real > const & | data, |
| core::Real const & | xmin, | ||
| core::Real const & | xbin | ||
| ) |
| core::scoring::func::CircularGeneral1D_Func::CircularGeneral1D_Func | ( | std::string const & | filename | ) |
References data_, num_bins_, protocols::hybridization::val, xbin_, and xmin_.
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inlineoverridevirtual |
This method must return a deep copy of this Func, meaning if this Func holds pointers to other Func objects, that it must clone those Func objects as well.
Implements core::scoring::func::Func.
Returns a value representing the derivative of this function evaluated at a given point.
Implements core::scoring::func::Func.
Returns a value representing this function evaluated at a given point.
Implements core::scoring::func::Func.
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overridevirtual |
Equality operator. Looks for strict equality. Floating-point comparison is the rule rather than the exception.
Implements core::scoring::func::Func.
References data_, num_bins_, same_type_as_me(), core::scoring::func::Func::same_type_as_me(), xbin_, and xmin_.
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overridevirtual |
Does the input Func, "other", have the same type as me? Necessary for the equality operator to function correctly. All derived Func classes must implement this function.
Implements core::scoring::func::Func.
Referenced by operator==().
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private |
Referenced by CircularGeneral1D_Func(), dfunc(), func(), and operator==().
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private |
Referenced by CircularGeneral1D_Func(), dfunc(), func(), and operator==().
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private |
Referenced by CircularGeneral1D_Func(), dfunc(), func(), and operator==().
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private |
Referenced by CircularGeneral1D_Func(), dfunc(), func(), and operator==().
1.8.7