#include <FullatomCustomPairDistanceEnergy.hh>
|
| | DistanceFunc (std::string const name) |
| | NOTE: distance functions should be input in square-distance bins. More...
|
| |
| virtual | ~DistanceFunc () |
| |
| func::FuncOP | clone () const |
| |
| virtual Real | func (Real const ) const |
| | Returns a value representing this function evaluated at a given point. More...
|
| |
| virtual Real | dfunc (Real const ) const |
| | Returns a value representing the derivative of this function evaluated at a given point. More...
|
| |
| virtual Real | max_dis () const |
| |
| virtual Real | min_dis () const |
| |
| virtual | ~Func () |
| | Automatically generated virtual destructor for class deriving directly from ReferenceCount. 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...
|
| |
| core::scoring::custom_pair_distance::DistanceFunc::DistanceFunc |
( |
std::string const |
name | ) |
|
| core::scoring::custom_pair_distance::DistanceFunc::~DistanceFunc |
( |
| ) |
|
|
virtual |
| func::FuncOP core::scoring::custom_pair_distance::DistanceFunc::clone |
( |
| ) |
const |
|
inlinevirtual |
| Real core::scoring::custom_pair_distance::DistanceFunc::dfunc |
( |
Real |
const | ) |
const |
|
virtual |
Returns a value representing the derivative of this function evaluated at a given point.
Implements core::scoring::func::Func.
| Real core::scoring::custom_pair_distance::DistanceFunc::func |
( |
Real |
const | ) |
const |
|
virtual |
| Real core::scoring::custom_pair_distance::DistanceFunc::max_dis |
( |
| ) |
const |
|
virtual |
| Real core::scoring::custom_pair_distance::DistanceFunc::min_dis |
( |
| ) |
const |
|
virtual |
The documentation for this class was generated from the following files: