Coarse_creator_two_barycenters< Residue > Class Template Reference

#include <coarse_creators.h>

Detailed Description

template<class Residue>
class SBL::CSB::Coarse_creator_two_barycenters< Residue >

This module gathers all objects provided to create coarse grain atoms from a residue. Such an object must be a class of the following type:

template <class Residue>
struct Coarse_creator_concept{
  //a string indicating how the coarse grained model is defined.
  static const std::string info(){ ... }
 
  // Creates coarse grain atoms from a residue.
  // Output_iterator is an output iterator of coarse grain atoms.
  // the integer returned is the number of coarse grain atoms created.
  template <class Output_iterator>
  int operator()(const Residue& res,Output_iterator out) const{ ... }
};

Creator of a coarse grain model creating up to two pseudo-atoms: one as the barycenter of backbone atoms (if relevant) and one as the barycenter of non-barycenter atoms. Backbone atoms are identified using the global function SBL::is_backbone.

Template Parameters

Residue

is the coarse grain residue type used.