OpenMD 3.0
Molecular Dynamics in the Open
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"types/ImproperCosineInversionType.hpp" More...
#include <ImproperCosineInversionType.hpp>
Public Member Functions | |
ImproperCosineInversionType (std::vector< ImproperCosineInversionParameter > ¶meters) | |
Public Member Functions inherited from OpenMD::PolynomialInversionType | |
RealType | getCoefficient (int power) |
void | addCoefficient (int power, RealType coefficient) |
void | setCoefficient (int power, RealType coefficient) |
void | setPolynomial (DoublePolynomial p) |
virtual InversionKey | getKey () |
virtual void | calcForce (RealType cosPhi, RealType &V, RealType &dVdCosPhi) |
"types/ImproperCosineInversionType.hpp"
Definition at line 83 of file ImproperCosineInversionType.hpp.
OpenMD::ImproperCosineInversionType::ImproperCosineInversionType | ( | std::vector< ImproperCosineInversionParameter > & | parameters | ) |
Definition at line 55 of file ImproperCosineInversionType.cpp.