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OBBuilder Member List

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

AddNbrs(OBBitVec &fragment, OBAtom *atom) | OBBuilder | static
AddRingFragment(OBSmartsPattern *sp, const std::vector< vector3 > &coords) | OBBuilder |
Build(OBMol &mol, bool stereoWarnings=true) | OBBuilder |
Connect(OBMol &mol, int a, int b, vector3 &newpos, int bondOrder=1) | OBBuilder | static
Connect(OBMol &mol, int a, int b, int bondOrder=1) | OBBuilder | static
CorrectStereoAtoms(OBMol &mol, bool warn=true) | OBBuilder | static
CorrectStereoBonds(OBMol &mol) | OBBuilder | static
GetFragment(OBAtom *atom) | OBBuilder | static
GetFragmentCoord(std::string smiles) | OBBuilder |
GetNewBondVector(OBAtom *atom) | OBBuilder | static
GetNewBondVector(OBAtom *atom, double length) | OBBuilder | static
IsSpiroAtom(unsigned long atomId, OBMol &mol) | OBBuilder | static
LoadFragments() | OBBuilder |
OBBuilder() | OBBuilder | inline
SetKeepRings() | OBBuilder | inline
Swap(OBMol &mol, int a, int b, int c, int d) | OBBuilder | static
UnsetKeepRings() | OBBuilder | inline