indigoX
Forcefield Member List

This is the complete list of members for Forcefield, including all inherited members.

cereal::access classForcefieldfriend
Family enum nameForcefield
Forcefield()=defaultForcefield
Forcefield(const Forcefield &)=defaultForcefield
Forcefield(Forcefield &&)=defaultForcefield
Forcefield(Family family, std::string name)Forcefield
GetAngleType(AngleType type, int32_t id) constForcefield
GetAngleType(int32_t id) constForcefield
GetAtomType(std::string name) constForcefield
GetAtomType(int32_t id) constForcefield
GetBondType(BondType type, int32_t id) constForcefield
GetBondType(int32_t id) constForcefield
GetDihedralType(DihedralType type, int32_t id) constForcefield
GetDihedralType(int32_t id) constForcefield
GetFamily() constForcefield
GetName() constForcefield
LinkAngleTypes(const FFAngle &a, const FFAngle &b)Forcefield
LinkBondTypes(const FFBond &a, const FFBond &b)Forcefield
NewAngleType(AngleType type, int32_t id, double a, double b)Forcefield
NewAtomType(int32_t id, std::string name, const Element &element)Forcefield
NewBondType(BondType type, int32_t id, double a, double b)Forcefield
NewDihedralType(DihedralType type, int32_t id, double a, double b, double c)Forcefield
NewDihedralType(DihedralType type, int32_t id, double a, double b)Forcefield
NumAngleTypes() constForcefield
NumAngleTypes(AngleType type) constForcefield
NumAtomTypes() constForcefield
NumBondTypes() constForcefield
NumBondTypes(BondType type) constForcefield
NumDihedralTypes() constForcefield
NumDihedralTypes(DihedralType type) constForcefield
operator bool() constForcefieldinline
operator!=(const Forcefield &ff) constForcefieldinline
operator<(const Forcefield &ff) constForcefield
operator<<(std::ostream &os, const Forcefield &ff)Forcefieldfriend
operator<=(const Forcefield &ff) constForcefieldinline
operator=(const Forcefield &)=defaultForcefield
operator=(Forcefield &&)=defaultForcefield
operator==(const Forcefield &ff) constForcefield
operator>(const Forcefield &ff) constForcefield
operator>=(const Forcefield &ff) constForcefieldinline
ReserveAngleTypes(AngleType type, size_t size)Forcefield
ReserveAtomTypes(size_t size)Forcefield
ReserveBondTypes(BondType type, size_t size)Forcefield
ReserveDihedralTypes(DihedralType type, size_t size)Forcefield
~ Forcefield()=defaultForcefield