Structural Bioinformatics Library
Template C++ / Python API for developping structural bioinformatics applications.
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Coarse_creator_closest_to_barycenter< Residue, FT_ > Class Template Reference
Coarse grain creator

#include <coarse_creators.h>

Detailed Description

template<class Residue, class FT_>
class ESBTL::Coarse_creator_closest_to_barycenter< Residue, FT_ >

Creator of a coarse grain model using one pseudo-atom centered at the atom closest to the barycenter of the side-chain and the C-alpha of a residue. These atoms are identified using the global function ESBTL::is_side_chain_or_CA.

Template Parameters
Residueis the coarse grain residue type used.
FT_is the number type of the coordinates.