bonded_tab.hpp File Reference

Routines to calculate the energy and/or force for particle bonds, angles and dihedrals via interpolation of lookup tables. More...

#include "config/config.hpp"
#include "TabulatedPotential.hpp"
#include "angle_common.hpp"
#include "bonded_interactions/dihedral.hpp"
#include <utils/Vector.hpp>
#include <utils/math/sqr.hpp>
#include <cassert>
#include <cmath>
#include <memory>
#include <numbers>
#include <optional>
#include <tuple>
#include <vector>

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Classes
struct	TabulatedBond
	Base class for n-body tabulated potential (n=2,3,4). More...
struct	TabulatedDistanceBond
	Parameters for 2-body tabulated potential. More...
struct	TabulatedAngleBond
	Parameters for 3-body tabulated potential. More...
struct	TabulatedDihedralBond
	Parameters for 4-body tabulated potential. More...

Detailed Description

Routines to calculate the energy and/or force for particle bonds, angles and dihedrals via interpolation of lookup tables.

Definition in file bonded_tab.hpp.