rdkit.Chem.FunctionalGroups

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: os, weakref, re, StringIO, RDConfig