Package rdkit :: Package Chem :: Module FunctionalGroups
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Module FunctionalGroups

source code

Classes [hide private]
  FGHierarchyNode
  FuncGroupFileParseError
Functions [hide private]
 
BuildFuncGroupHierarchy(fileNm=None, data=None, force=False) source code
 
_SetNodeBits(mol, node, res, idx) source code
 
CreateMolFingerprint(mol, hierarchy) source code
Variables [hide private]
  groupDefns = {}
  hierarchy = None
hash(x)
  lastData = None
hash(x)
  lastFilename = None
hash(x)
  __package__ = 'rdkit.Chem'

Imports: RDConfig, os, weakref, cStringIO, re