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Rosetta 3.5
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a variant of the bound func that is periodic More...
#include <BoundConstraint.hh>


Public Types | |
| typedef BoundFunc | parent |
Public Member Functions | |
| PeriodicBoundFunc (Real const lb, Real const ub, Real sd, std::string type, Real const periodicity_in) | |
| FuncOP | clone () const |
| void | read_data (std::istream &) |
| initialize this Func from the given std::istream. More... | |
| Real | func (Real const x) const |
| Returns a value representing this function evaluated at a given point. More... | |
| Real | dfunc (Real const x) const |
| Returns a value representing the derivative of this function evaluated at a given point. More... | |
| 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 x, Size verbose_level, Real threshold=1) const |
| show some sort of stringified representation of the violations for this constraint. More... | |
Public Member Functions inherited from core::scoring::constraints::BoundFunc | |
| BoundFunc (Real const lb, Real const ub, Real sd, std::string type) | |
| BoundFunc (Real const lb, Real const ub, Real sd, Real rswitch, std::string type) | |
| Real | lb () const |
| Real | ub () const |
| Real | sd () const |
| Real | rswitch () const |
| std::string | type () const |
Public Member Functions inherited from core::scoring::constraints::Func | |
| virtual | ~Func () |
| Automatically generated virtual destructor for class deriving directly from ReferenceCount. 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... | |
Private Attributes | |
| Real | periodicity_ |
a variant of the bound func that is periodic
Definition at line 84 of file BoundConstraint.hh.
Definition at line 87 of file BoundConstraint.hh.
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inline |
Definition at line 90 of file BoundConstraint.hh.
Referenced by clone().
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inlinevirtual |
Reimplemented from core::scoring::constraints::BoundFunc.
Definition at line 101 of file BoundConstraint.hh.
References PeriodicBoundFunc().
Returns a value representing the derivative of this function evaluated at a given point.
Reimplemented from core::scoring::constraints::BoundFunc.
Definition at line 110 of file BoundConstraint.hh.
References core::scoring::constraints::BoundFunc::dfunc(), and periodicity_.
Returns a value representing this function evaluated at a given point.
Reimplemented from core::scoring::constraints::BoundFunc.
Definition at line 105 of file BoundConstraint.hh.
References core::scoring::constraints::BoundFunc::func(), and periodicity_.
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virtual |
initialize this Func from the given std::istream.
Reimplemented from core::scoring::constraints::BoundFunc.
Definition at line 151 of file BoundConstraint.cc.
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virtual |
shows the definition of this function, usually the string type of function and the parameters passed in to the constructor.
Reimplemented from core::scoring::constraints::BoundFunc.
Definition at line 143 of file BoundConstraint.cc.
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inlinevirtual |
show some sort of stringified representation of the violations for this constraint.
Reimplemented from core::scoring::constraints::BoundFunc.
Definition at line 117 of file BoundConstraint.hh.
References periodicity_, and core::scoring::constraints::BoundFunc::show_violations().
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private |
Definition at line 123 of file BoundConstraint.hh.
Referenced by dfunc(), func(), and show_violations().
1.8.4