NAMD
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This is the complete list of members for ABoundPosRestraint, including all inherited members.
APosRestraint() | APosRestraint | |
ARestraint() | ARestraint | |
DistributeForce(int WhichGroup, AVector Force, GlobalMasterFreeEnergy &CFE) | ARestraint | |
EarlyExit(const char *Str, int AtomID) | ARestraint | protected |
Get_dU_dLambda() | ARestraint | inlinevirtual |
GetAngle(AVector &A, AVector &B, AVector &C) | ARestraint | protected |
GetBound() | ABoundPosRestraint | inline |
GetDihe(AVector &A, AVector &B, AVector &C, AVector &D) | ARestraint | protected |
GetDistance() | ABoundPosRestraint | inlinevirtual |
GetE(AVector RefPos, double LambdaKf=1.0) | APosRestraint | protected |
GetEnergy() | ABoundPosRestraint | virtual |
GetGrad(int WhichGroup, AVector RefPos, double LambdaKf=1.0) | APosRestraint | protected |
GetGradient(int WhichGroup) | ABoundPosRestraint | virtual |
GetKf() | ARestraint | inline |
GetLambdaKf() | ARestraint | inline |
GetLambdaRef() | ARestraint | inline |
GetNumGroups() | ARestraint | inline |
GetPosTarget() | ABoundPosRestraint | inlinevirtual |
GetRefDist() | ABoundPosRestraint | inline |
GetRefPos() | ABoundPosRestraint | inline |
GetStr(char *Str) | ABoundPosRestraint | inlinevirtual |
IsForcing() | ARestraint | inlinevirtual |
m_Kf | ARestraint | protected |
m_LambdaKf | ARestraint | protectedstatic |
m_LambdaRef | ARestraint | protectedstatic |
m_NumGroups | ARestraint | protected |
m_pCOMs | ARestraint | protected |
m_pGroups | ARestraint | protected |
PrintInfo() | APosRestraint | virtual |
SetBound(Bound_t Bound) | ABoundPosRestraint | inlinevirtual |
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 | inlinevirtual |
SetKf(double Kf) | ARestraint | inline |
SetLambdaKf(double LambdaKf) | ARestraint | inline |
SetLambdaRef(double LambdaRef) | ARestraint | inline |
SetLowerAngle(double) | ARestraint | inlinevirtual |
SetRefAngle(double) | ARestraint | inlinevirtual |
SetRefDist(double Dist) | ABoundPosRestraint | inlinevirtual |
SetRefPos(AVector Pos) | ABoundPosRestraint | inlinevirtual |
SetStartAngle(double) | ARestraint | inlinevirtual |
SetStartDist(double) | ARestraint | inlinevirtual |
SetStartPos(AVector) | ARestraint | inlinevirtual |
SetStopAngle(double) | ARestraint | inlinevirtual |
SetStopDist(double) | ARestraint | inlinevirtual |
SetStopPos(AVector) | ARestraint | inlinevirtual |
SetUpperAngle(double) | ARestraint | inlinevirtual |
UpdateCOMs(GlobalMasterFreeEnergy &CFE) | ARestraint | |
~ARestraint() | ARestraint | virtual |