c

OpenBabel::OBFFParameter::c() OpenBabel::OBFFCalculation3::c() OpenBabel::OBFFConstraint::c() OpenBabel::GasteigerState::c() OpenBabel::OBResidueIndex::C()

CairoPainter OpenBabel

CairoPainter OpenBabel::CairoPainter

cairopainter.cpp

cairopainter.h

calc_rms OpenBabel

CalcBondLength OpenBabel::OBRotor

CalcSignedVolume OpenBabel

CalcTorsion OpenBabel::OBRotor

CalcTorsionAngle OpenBabel

calcvolume OpenBabel

CanBeNormalized OpenBabel::vector3

CanBeSquared OpenBabel

canon.cpp

canon.h

CanonicalLabels OpenBabel

canonizeMCDL OpenBabel

CartesianToFractional OpenBabel::OBUnitCell

CartesianToInternal OpenBabel

CastAndClear OpenBabel::OBBase

cell OpenBabel::OBProxGrid

center

OpenBabel::OBSquarePlanarStereo::Config::center() OpenBabel::OBTetrahedralStereo::Config::center() OpenBabel::OBFloatGrid::Center() OpenBabel::OBScoreGrid::Center() OpenBabel::OBMol::Center() OpenBabel::OBMol::Center(int nconf)

center_coords

OpenBabel::center_coords(double *, int) OpenBabel::center_coords(double *c, unsigned int size)

CenterMol OpenBabel::OBScoreGrid

chains.cpp

chains.h

ChainsAtomName OpenBabel

chainsparser OpenBabel

ChainsResName chains.cpp

changeParity OpenBabel

changeParityBond OpenBabel

ChangeView OpenBabel::OBTetraNonPlanarStereo

ChangeWinding OpenBabel::OBTetraNonPlanarStereo

CHARGED OpenBabel::OBAminoAcidProperty

ChargeData OpenBabel::OBGenericDataType

chargemodel.cpp

chargemodel.h

chargeVal OpenBabel

CharPtrLess OpenBabel

CheckAromaticity OpenBabel::OBAromaticTyper

CheckedForGzip OpenBabel::OBConversion

CheckForUnintendedBatch OpenBabel::OBConversion

CheckFP OpenBabel::FptIndex

ChemScore OpenBabel

chi OpenBabel::GasteigerState

chiral.cpp

chiral.h

chiral_flag OpenBabel::AtomSpec

ChiralData OpenBabel::OBGenericDataType

CisOrTrans OpenBabel::OBBond

CisTrans OpenBabel::OBStereo

cistrans.h

CisTransFrom0D OpenBabel

CisTransFrom2D OpenBabel

CisTransFrom3D OpenBabel

ClassCount OpenBabel

ClassDescription

OpenBabel::OBBase::ClassDescription() OpenBabel::OBMol::ClassDescription() OpenBabel::OBReaction::ClassDescription()

CleanAtomType OpenBabel

clear

ClearBond OpenBabel::OBAtom

ClearCoordPtr OpenBabel::OBAtom

ClearGradients OpenBabel::OBForceField

ClearGroups OpenBabel::OBForceField

ClearLog OpenBabel::OBMessageHandler

ClearOptions OpenBabel::OBDepict

ClearSymmetry OpenBabel::OBGraphSym

Clockwise OpenBabel::OBStereo

Clone

CloneData OpenBabel::OBBase

CloseOutFile OpenBabel::OBConversion

closindex OpenBabel::ParseState

closord OpenBabel::ParseState

closure

OpenBabel::ParseState::closure() OpenBabel::OBBond::Closure()

COA OpenBabel::OBResidueIndex

Coeffs OpenBabel::OBNasaThermoData

COENZYME OpenBabel::OBResidueProperty

CommentData OpenBabel::OBGenericDataType

Compare OpenBabel::OBDescriptor

compareAtoms OpenBabel

CompareBondPairSecond OpenBabel

ComparePairFirst OpenBabel

ComparePairSecond OpenBabel

CompareRingSize OpenBabel

CompareRotor

OpenBabel::CompareRotor(const pair< int, int > &a, const pair< int, int > &b) OpenBabel::CompareRotor(const pair< OBBond *, int > &, const pair< OBBond *, int > &)

compareStringsNumbers OpenBabel

CompareStringWithFilter OpenBabel::OBDescriptor

CompareUnsigned OpenBabel

CompileAutomorphismQuery OpenBabel

CompileMoleculeQuery OpenBabel

CompileSmilesQuery OpenBabel

ComputeCharges OpenBabel::OBChargeModel

Config OpenBabel::OBSquarePlanarStereo

Config OpenBabel::OBTetrahedralStereo

Config OpenBabel::OBCisTransStereo

Config

OpenBabel::OBScoreGrid::Config() OpenBabel::OBCisTransStereo::Config::Config() OpenBabel::OBCisTransStereo::Config::Config(unsigned long _begin, unsigned long _end, const OBStereo::Refs &_refs, OBStereo::Shape _shape=OBStereo::ShapeU) OpenBabel::OBSquarePlanarStereo::Config::Config() OpenBabel::OBSquarePlanarStereo::Config::Config(unsigned long _center, const OBStereo::Refs &_refs, OBStereo::Shape _shape=OBStereo::ShapeU) OpenBabel::OBTetrahedralStereo::Config::Config() OpenBabel::OBTetrahedralStereo::Config::Config(unsigned long _center, unsigned long from_or_towards, const OBStereo::Refs &_refs, OBStereo::Winding _winding=OBStereo::Clockwise, OBStereo::View _view=OBStereo::ViewFrom)

ConformerData OpenBabel::OBGenericDataType

conformersearch.cpp

conformersearch.h

ConjugateGradients OpenBabel::OBForceField

ConjugateGradientsInitialize OpenBabel::OBForceField

ConjugateGradientsTakeNSteps OpenBabel::OBForceField

Connect

OpenBabel::OBBuilder::Connect(OBMol &mol, int a, int b, vector3 &newpos, int bondOrder=1) OpenBabel::OBBuilder::Connect(OBMol &mol, int a, int b, int bondOrder=1)

ConnectTheDots OpenBabel::OBMol

CONNMAX mcdlutil.cpp

ConstrainRecursion OpenBabel

constraint_value OpenBabel::OBFFConstraint

ConstRefIter OpenBabel::OBStereo

construct_c_matrix OpenBabel

construct_g_matrix OpenBabel

ContainsRef OpenBabel::OBStereo

ContainsSameRefs OpenBabel::OBStereo

ContigFragList OpenBabel::OBMol

Convergence OpenBabel::OBConformerScore

Convert

OpenBabel::OBConversion::Convert(std::istream *is, std::ostream *os) OpenBabel::OBConversion::Convert()

convert_matrix_f

OpenBabel::convert_matrix_f(std::vector< std::vector< double > > &src, double *dst) OpenBabel::convert_matrix_f(double *src, std::vector< std::vector< double > > &dst, int rows, int cols)

convert_matrix_f_ff OpenBabel

convert_matrix_ff

OpenBabel::convert_matrix_ff(std::vector< std::vector< double > > &src, double **dst) OpenBabel::convert_matrix_ff(double **src, std::vector< std::vector< double > > &dst, int rows, int cols)

convert_matrix_ff_f OpenBabel

ConvertDativeBonds OpenBabel::OBMol

CoordsToIndex

OpenBabel::OBFloatGrid::CoordsToIndex(int *, double *) OpenBabel::OBFloatGrid::CoordsToIndex(double x, double y, double z)

copper OpenBabel

CopyAtomExpr OpenBabel

CopyBondExpr OpenBabel

CopyConformer OpenBabel::OBMol

CopyOptions OpenBabel::OBConversion

CopyPattern OpenBabel

CorrectAromaticNitrogens OpenBabel::OBAtomTyper

CorrectBadResonanceForm OpenBabel

CorrectChirality OpenBabel

CorrectedBondRad OpenBabel::OBElementTable

CorrectedVdwRad OpenBabel::OBElementTable

CorrectForPH

OpenBabel::OBMol::CorrectForPH() OpenBabel::OBPhModel::CorrectForPH()

CorrectStereoAtoms OpenBabel::OBBuilder

CorrectStereoBonds OpenBabel::OBBuilder

CorrectVelocities OpenBabel::OBForceField

Count OpenBabel::OBConversion

count_assigned_bonds OpenBabel

CountBits OpenBabel::OBBitVec

CountBondsOfOrder OpenBabel::OBAtom

CountFreeOxygens OpenBabel::OBAtom

CountRingBonds OpenBabel::OBAtom

CreateAtom

OpenBabel::OBMol::CreateAtom() OpenBabel::CreateAtom()

CreateBond

OpenBabel::OBMol::CreateBond() OpenBabel::CreateBond()

CreateConformerList OpenBabel::OBRotamerList

CreateNewClassVector OpenBabel

createOrthoVector OpenBabel::vector3

CreateResidue OpenBabel::OBMol

createStereoLists OpenBabel

cromium OpenBabel

cross OpenBabel

CubeRoot OpenBabel

Cubic OpenBabel::OBUnitCell

CurrentDepth

OpenBabel::OBMolAtomBFSIter::CurrentDepth() OpenBabel::OBMolBondBFSIter::CurrentDepth()

CustomData0 OpenBabel::OBGenericDataType

CustomData1 OpenBabel::OBGenericDataType

CustomData10 OpenBabel::OBGenericDataType

CustomData11 OpenBabel::OBGenericDataType

CustomData12 OpenBabel::OBGenericDataType

CustomData13 OpenBabel::OBGenericDataType

CustomData14 OpenBabel::OBGenericDataType

CustomData15 OpenBabel::OBGenericDataType

CustomData2 OpenBabel::OBGenericDataType

CustomData3 OpenBabel::OBGenericDataType

CustomData4 OpenBabel::OBGenericDataType

CustomData5 OpenBabel::OBGenericDataType

CustomData6 OpenBabel::OBGenericDataType

CustomData7 OpenBabel::OBGenericDataType

CustomData8 OpenBabel::OBGenericDataType

CustomData9 OpenBabel::OBGenericDataType

CYCLIC OpenBabel::OBAminoAcidProperty

CYS OpenBabel::OBResidueIndex

CYSTEINE_SULPHUR OpenBabel::OBResidueAtomProperty