Structural Bioinformatics Library
Template C++ / Python API for developping structural bioinformatics applications.
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Defines the gradient associated to the bond length. More...
#include <Molecular_potential_energy_gradient.hpp>
Defines the gradient associated to the bond length.
Defines the gradient associated to the bond length.
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 |