Rosetta  2020.50
 All Classes Namespaces Files Functions Variables Typedefs Enumerations Enumerator Friends Macros Pages
Classes | Namespaces
DEEREnergyCreator.hh File Reference

Parent class for DEEREnergy structure. More...

#include <core/scoring/methods/EnergyMethodCreator.hh>
#include <core/types.hh>
#include <utility/vector1.hh>

Classes

class  core::energy_methods::DEEREnergyCreator
 

Namespaces

 core
 A class for reading in the atom type properties.
 
 core::energy_methods
 

Detailed Description

Parent class for DEEREnergy structure.

To prevent the energy method from reading from the command line every scoring round and parsing the input file, this method constructs a faux-graph of DEER decay data. The "nodes" are the residues for which at least one set of data is provided, and the "edges" correspond to data sets for two residues. NOTE: There is a graph class in src/utility but it is unnecessarily heavy. Instead this class uses maps

Author
Diego del Alamo ( del.a.nosp@m.lamo.nosp@m.@vand.nosp@m.erbi.nosp@m.lt.ed.nosp@m.u )