AForcingDiheRestraint Member List

This is the complete list of members for AForcingDiheRestraint, including all inherited members.
ADiheRestraint()ADiheRestraint
ARestraint()ARestraint
DistributeForce(int WhichGroup, AVector Force, GlobalMasterFreeEnergy &CFE)ARestraint
EarlyExit(const char *Str, int AtomID)ARestraint [protected]
Get_dU_dLambda()AForcingDiheRestraint [virtual]
GetAngle(AVector &A, AVector &B, AVector &C)ARestraint [protected]
GetDihe(AVector &A, AVector &B, AVector &C, AVector &D)ARestraint [protected]
GetDiheTarget1()AForcingDiheRestraint [inline, virtual]
GetDiheTarget2()AForcingDiheRestraint [inline, virtual]
GetE(double RefDihe, double Const)ADiheRestraint [protected]
GetEnergy()AForcingDiheRestraint [virtual]
GetGrad(int WhichGroup, double RefDihe, double Const)ADiheRestraint [protected]
GetGradient(int WhichGroup)AForcingDiheRestraint [virtual]
GetKf()ARestraint [inline]
GetLambdaKf()ARestraint [inline]
GetLambdaRef()ARestraint [inline]
GetNumGroups()ARestraint [inline]
GetStartAngle()AForcingDiheRestraint [inline]
GetStopAngle()AForcingDiheRestraint [inline]
GetStr(char *Str)AForcingDiheRestraint [inline, virtual]
gradU(AVector &P1P2P3, AVector &P4P5P6, AVector &dP1, AVector &dP2, AVector &dP3, AVector &dP4, AVector &dP5, AVector &dP6)ADiheRestraint [protected]
IsForcing()AForcingDiheRestraint [inline, virtual]
m_KfARestraint [protected]
m_LambdaKfARestraint [protected, static]
m_LambdaRefARestraint [protected, static]
m_NumGroupsARestraint [protected]
m_pCOMsARestraint [protected]
m_pGroupsARestraint [protected]
PrintInfo()ADiheRestraint [virtual]
SetBound(Bound_t)ARestraint [inline, virtual]
SetGroup(AGroup &Group, int GroupIndex)ARestraint
SetGroups(AGroup &Group1)ARestraint
SetGroups(AGroup &Group1, AGroup &Group2)ARestraint
SetGroups(AGroup &Group1, AGroup &Group2, AGroup &Group3)ARestraint
SetGroups(AGroup &Group1, AGroup &Group2, AGroup &Group3, AGroup &Group4)ARestraint
SetIntervalAngle(double)ARestraint [inline, virtual]
SetKf(double Kf)ARestraint [inline]
SetLambdaKf(double LambdaKf)ARestraint [inline]
SetLambdaRef(double LambdaRef)ARestraint [inline]
SetLowerAngle(double)ARestraint [inline, virtual]
SetRefAngle(double)ARestraint [inline, virtual]
SetRefDist(double)ARestraint [inline, virtual]
SetRefPos(AVector)ARestraint [inline, virtual]
SetStartAngle(double Angle)AForcingDiheRestraint [inline, virtual]
SetStartDist(double)ARestraint [inline, virtual]
SetStartPos(AVector)ARestraint [inline, virtual]
SetStopAngle(double Angle)AForcingDiheRestraint [inline, virtual]
SetStopDist(double)ARestraint [inline, virtual]
SetStopPos(AVector)ARestraint [inline, virtual]
SetUpperAngle(double)ARestraint [inline, virtual]
TwoTargets()AForcingDiheRestraint [inline, virtual]
UpdateCOMs(GlobalMasterFreeEnergy &CFE)ARestraint
~ARestraint()ARestraint [virtual]

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