AssignTorVals(OBMol &) | OBRotorList | |
BeginRotor(OBRotorIterator &i) | OBRotorList | [inline] |
BeginRotors() | OBRotorList | [inline] |
Clear() | OBRotorList | |
EndRotors() | OBRotorList | [inline] |
FindRotors(OBMol &) | OBRotorList | |
HasFixedAtoms() | OBRotorList | [inline] |
IdentifyEvalAtoms(OBMol &mol) | OBRotorList | [inline] |
IgnoreSymmetryRemoval() | OBRotorList | [inline] |
Init(std::string &fname) | OBRotorList | [inline] |
IsFixedBond(OBBond *) | OBRotorList | |
NextRotor(OBRotorIterator &i) | OBRotorList | [inline] |
OBRotorList() | OBRotorList | |
RemoveSymVals(OBMol &) | OBRotorList | |
SetEvalAtoms(OBMol &) | OBRotorList | |
SetFixAtoms(OBBitVec &fix) | OBRotorList | [inline] |
SetQuiet() | OBRotorList | [inline] |
SetRotAtoms(OBMol &) | OBRotorList | |
SetRotAtomsByFix(OBMol &) | OBRotorList | |
Setup(OBMol &) | OBRotorList | |
Size() | OBRotorList | [inline] |
~OBRotorList() | OBRotorList |