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Rosetta Core
2014.16.56682
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#include <FullatomDisulfidePotential.hh>
Public Member Functions | |
| SG_Dist_Func () | |
| Access the histogram for this Func (in degrees) More... | |
| ~SG_Dist_Func () | |
| func::FuncOP | clone () const |
| virtual Real | func (Real const ) const |
| virtual Real | dfunc (Real const ) const |
Public Member Functions inherited from core::scoring::func::Func | |
| 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... | |
Static Private Member Functions | |
| static numeric::interpolation::HistogramCOP < core::Real, core::Real > ::Type | fa_ssdist_scores () |
| Access the histogram for this Func. More... | |
| static numeric::interpolation::HistogramCOP < core::Real, core::Real > ::Type | fa_ssdist_scores_deriv () |
| Access the histogram for this Func's derivative. More... | |
| core::scoring::disulfides::SG_Dist_Func::SG_Dist_Func | ( | ) |
Access the histogram for this Func (in degrees)
Referenced by clone().
| core::scoring::disulfides::SG_Dist_Func::~SG_Dist_Func | ( | ) |
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inlinevirtual |
Implements core::scoring::func::Func.
References SG_Dist_Func().
| ssdist[in] | S-S distance, in Angstroms |
Implements core::scoring::func::Func.
References fa_ssdist_scores().
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staticprivate |
Access the histogram for this Func.
References utility::io::izstream::close(), and basic::database::open().
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staticprivate |
Access the histogram for this Func's derivative.
| ssdist[in] | S-S distance, in Angstroms |
Implements core::scoring::func::Func.
References fa_ssdist_scores().
1.8.7