Simpatico  v1.10
McMd::DihedralPotential Member List

This is the complete list of members for McMd::DihedralPotential, including all inherited members.

add(std::istream &in, const char *label, Type &value, bool isRequired=true)Util::ParamCompositeprotected
addBegin(const char *label)Util::ParamComposite
addBlank()Util::ParamComposite
addCArray(std::istream &in, const char *label, Type *value, int n, bool isRequired=true)Util::ParamCompositeprotected
addCArray2D(std::istream &in, const char *label, Type *value, int m, int n, int np, bool isRequired=true)Util::ParamCompositeprotected
addComponent(ParamComponent &param, bool isLeaf=true)Util::ParamCompositeprotected
addDArray(std::istream &in, const char *label, DArray< Type > &array, int n, bool isRequired=true)Util::ParamCompositeprotected
addDMatrix(std::istream &in, const char *label, DMatrix< Type > &matrix, int m, int n, bool isRequired=true)Util::ParamCompositeprotected
addEnd()Util::ParamComposite
addFArray(std::istream &in, const char *label, FArray< Type, N > &array, bool isRequired=true)Util::ParamCompositeprotected
addForces()=0McMd::DihedralPotentialpure virtual
addParamComposite(ParamComposite &child, bool next=true)Util::ParamComposite
atomEnergy(const Atom &atom) const McMd::DihedralPotentialinlinevirtual
className() const Util::ParamCompositeinline
clearCommunicator()Util::MpiFileIo
computeEnergy()=0McMd::EnergyCalculatorpure virtual
computeStress()McMd::StressCalculatorinlinevirtual
computeStress(Tensor &stress)McMd::StressCalculator
computeStress(Vector &pressures)McMd::StressCalculator
computeStress(double &pressure)McMd::StressCalculator
createsStress() const McMd::StressCalculator
DihedralPotential()McMd::DihedralPotential
echo()Util::ParamComponentstatic
energy(const Vector &R1, const Vector &R2, const Vector &R3, int type) const =0McMd::DihedralPotentialpure virtual
McMd::EnergyCalculator::energy()McMd::EnergyCalculator
force(const Vector &R1, const Vector &R2, const Vector &R3, Vector &F1, Vector &F2, Vector &F3, int type) const =0McMd::DihedralPotentialpure virtual
get(std::string name, int type) const =0McMd::DihedralPotentialpure virtual
hasIoCommunicator() const Util::MpiFileIoinline
IArchive typedefUtil::Serializable
indent() const Util::ParamComponent
initStatic()Util::ParamComponentstatic
interactionClassName() const =0McMd::DihedralPotentialpure virtual
ioCommunicator() const Util::MpiFileIoinline
isActive() const Util::ParamCompositeinline
isIoProcessor() const Util::MpiFileIoinline
isRequired() const Util::ParamCompositeinline
load(Serializable::IArchive &ar)Util::ParamCompositevirtual
loadCArray(Serializable::IArchive &ar, const char *label, Type *value, int n, bool isRequired)Util::ParamComposite
loadCArray(Serializable::IArchive &ar, const char *label, Type *value, int n)Util::ParamCompositeinline
loadCArray2D(Serializable::IArchive &ar, const char *label, Type *value, int m, int n, int np, bool isRequired)Util::ParamComposite
loadCArray2D(Serializable::IArchive &ar, const char *label, Type *value, int m, int n, int np)Util::ParamComposite
loadDArray(Serializable::IArchive &ar, const char *label, DArray< Type > &array, int n, bool isRequired)Util::ParamComposite
loadDArray(Serializable::IArchive &ar, const char *label, DArray< Type > &array, int n)Util::ParamCompositeinline
loadDMatrix(Serializable::IArchive &ar, const char *label, DMatrix< Type > &matrix, int m, int n, bool isRequired)Util::ParamComposite
loadDMatrix(Serializable::IArchive &ar, const char *label, DMatrix< Type > &matrix, int m, int n)Util::ParamCompositeinline
loadDSymmMatrix(Serializable::IArchive &ar, const char *label, DMatrix< Type > &matrix, int n, bool isRequired)Util::ParamComposite
loadDSymmMatrix(Serializable::IArchive &ar, const char *label, DMatrix< Type > &matrix, int n)Util::ParamCompositeinline
loadFArray(Serializable::IArchive &ar, const char *label, FArray< Type, N > &array, bool isRequired)Util::ParamComposite
loadFArray(Serializable::IArchive &ar, const char *label, FArray< Type, N > &array)Util::ParamCompositeinline
loadOptional(Serializable::IArchive &ar)Util::ParamCompositevirtual
loadParamComposite(Serializable::IArchive &ar, ParamComposite &child, bool next=true)Util::ParamComposite
loadParamCompositeOptional(Serializable::IArchive &ar, ParamComposite &child, bool next=true)Util::ParamComposite
loadParameter(Serializable::IArchive &ar, const char *label, Type &value, bool isRequired)Util::ParamComposite
loadParameter(Serializable::IArchive &ar, const char *label, Type &value)Util::ParamCompositeinline
loadParameters(Serializable::IArchive &ar)Util::ParamCompositeinlinevirtual
MpiFileIo()Util::MpiFileIo
MpiFileIo(const MpiFileIo &other)Util::MpiFileIo
OArchive typedefUtil::Serializable
ParamComponent()Util::ParamComponentprotected
ParamComponent(const ParamComponent &other)Util::ParamComponentprotected
ParamComposite()Util::ParamComposite
ParamComposite(const ParamComposite &other)Util::ParamComposite
ParamComposite(int capacity)Util::ParamComposite
read(std::istream &in, const char *label, Type &value)Util::ParamComposite
readBegin(std::istream &in, const char *label, bool isRequired=true)Util::ParamComposite
readBlank(std::istream &in)Util::ParamComposite
readCArray(std::istream &in, const char *label, Type *value, int n)Util::ParamCompositeinline
readCArray2D(std::istream &in, const char *label, Type *value, int m, int n, int np)Util::ParamCompositeinline
readDArray(std::istream &in, const char *label, DArray< Type > &array, int n)Util::ParamCompositeinline
readDMatrix(std::istream &in, const char *label, DMatrix< Type > &matrix, int m, int n)Util::ParamCompositeinline
readDSymmMatrix(std::istream &in, const char *label, DMatrix< Type > &matrix, int n)Util::ParamCompositeinline
readEnd(std::istream &in)Util::ParamComposite
readFArray(std::istream &in, const char *label, FArray< Type, N > &array)Util::ParamCompositeinline
readOptional(std::istream &in, const char *label, Type &value)Util::ParamCompositeinline
readOptionalCArray(std::istream &in, const char *label, Type *value, int n)Util::ParamCompositeinline
readOptionalCArray2D(std::istream &in, const char *label, Type *value, int m, int n, int np)Util::ParamCompositeinline
readOptionalDArray(std::istream &in, const char *label, DArray< Type > &array, int n)Util::ParamCompositeinline
readOptionalDMatrix(std::istream &in, const char *label, DMatrix< Type > &matrix, int m, int n)Util::ParamCompositeinline
readOptionalDSymmMatrix(std::istream &in, const char *label, DMatrix< Type > &matrix, int n)Util::ParamCompositeinline
readOptionalFArray(std::istream &in, const char *label, FArray< Type, N > &array)Util::ParamCompositeinline
readParam(std::istream &in)Util::ParamCompositevirtual
readParamComposite(std::istream &in, ParamComposite &child, bool next=true)Util::ParamComposite
readParamCompositeOptional(std::istream &in, ParamComposite &child, bool next=true)Util::ParamComposite
readParameters(std::istream &in)Util::ParamCompositeinlinevirtual
readParamOptional(std::istream &in)Util::ParamCompositevirtual
resetParam()Util::ParamCompositevirtual
save(Serializable::OArchive &ar)Util::ParamCompositevirtual
saveOptional(Serializable::OArchive &ar)Util::ParamComposite
serialize(Archive &ar, const unsigned int version)Util::ParamComponent
set(std::string name, int type, double value)=0McMd::DihedralPotentialpure virtual
setClassName(const char *className)Util::ParamCompositeprotected
setEcho(bool echo=true)Util::ParamComponentstatic
setIndent(const ParamComponent &parent, bool next=true)Util::ParamComponent
setIoCommunicator(MPI::Intracomm &communicator)Util::MpiFileIo
setIsActive(bool isActive)Util::ParamCompositeprotected
setIsRequired(bool isRequired)Util::ParamCompositeprotected
setParent(ParamComponent &param, bool next=true)Util::ParamCompositeprotected
StressCalculator(bool createsStress=true)McMd::StressCalculatorprotected
unsetEnergy()McMd::EnergyCalculatorvirtual
unsetStress()McMd::StressCalculatorvirtual
writeParam(std::ostream &out)Util::ParamCompositevirtual
~DihedralPotential()McMd::DihedralPotentialvirtual
~ParamComponent()Util::ParamComponentvirtual
~ParamComposite()Util::ParamCompositevirtual
~Serializable()Util::Serializableinlinevirtual