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Home ChemPack CStruct Methods, Properties and Declarations of CStruct
See also: Interface of SDL_CStruct, Connection Table, Connection Table - Principles, How to use TCTab 

Methods, Properties and Declarations of CStruct

Constants and Type Declarations
Global Constants AtFlagType AtListType
BondListType CoordUnitsType CTElem
FrgType RingType RingListType
SSSMode TCTab


Procedures
ClearCTElem FragmentStr RingInRingList

Class TCTab

Properties
AtAttrib AtCharge AtConnTo
AtCoords AtFlag AtNum
AtomEntries AtTypConn AtWeight
BinCASNr CASNr CoordinatesPresent
CoordUnits NAtoms NBonds
StrucName

Methods
AddAtom AtomCount CalcAttributes
CalcChemMolWeight CalcMissingH CalcMolCenter
CalcMolecularFormula CalcMolExtents Changed
CheckConnect Clear ClearAttributes
CompareWith ContainsUnconnectedAtom CopyFrom
Create DeleteAtom Destroy
EnterConn FindAtomInBox FindClosestAtom
FindNextEndAtom FindShortestRings FindSSSR
FragmentCode FragmentCount Free
JoinFragment LinkFragment MakeConnection
MakeSymmetricConnections MatchAtomTemplate MaxNBonds
NrHAtoms ReadFromClearTextFile ReadFromClearTextFileCTABG
ReadFromMDLCTabFile ReadFromMDLCTabStream ReadFromMDLMolFile
ReadFromMDLMolStream RemoveHydrogen RingsInMolecule
RotateWithPCA SearchSubStruc StripFromChains
SumForContained WriteToClearTextFile WriteToMDLCTabFile
WriteToMDLCTabStream WriteToMDLMolFile WriteToMDLMolStream
WriteToMolConnXFile

Events
OnChange

Last Update: 2023-Feb-06