T_Molecular_potential_energy_cmap_term< ConformationType, CovalentStructure, PotentialEnergyParameters > Class Template Reference

Defines the CMap term associated to a pair of proper dihedral angles.
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#include <Molecular_potential_energy.hpp>

Detailed Description

template<class ConformationType, class CovalentStructure, class PotentialEnergyParameters>
class SBL::CSB::T_Molecular_potential_energy_cmap_term< ConformationType, CovalentStructure, PotentialEnergyParameters >

Defines the CMap term associated to a pair of proper dihedral angles.

The cmap term is defined for all distinct pairs of dihedral angles, even if in practice, it is offenly computed only for backbones dihedrals.

Template Parameters

ConformationType	The type of the input geometric conformation, as defined in the package Molecular_conformation
CovalentStructure	The type of the input covalent structure, as defined in the package Molecular_covalent_structure
PotentialEnergyParameters	Class defining the parameters of the associated force field as the class SBL::IO::T_Potential_energy_parameters