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smis =
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mols = [Chem.MolFromSmiles(x) for x in smis]
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supplier = Supply.SupplyNode(contents= mols)
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metals =
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smaFilter = SmartsMolFilter.SmartsFilter(patterns= [metals], c
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salts =
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remover = SmartsRemover.SmartsRemover(patterns= salts)
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atsFilter = Filter.FilterNode(func= lambda x: x.GetNumAtoms()
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dupeFilter = SmilesDupeFilter.DupeFilter()
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io = StringIO.StringIO()
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output = SmilesOutput.OutputNode(dest= io, delim= ', ', idFiel
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__package__ =
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i = 6
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x = <rdkit.Chem.rdchem.Mol object at 0xac6f71b8>
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Imports: RDConfig, Chem, os, Supply, Filter, StringIO, SDSupply, SmartsMolFilter, SmartsRemover, SmilesDupeFilter, SmilesOutput
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smis
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metals
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smaFilter
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atsFilter
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output
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