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object --+ | Node.VLibNode --+ | Filter.FilterNode --+ | DupeFilter
canonical-smiles based duplicate filter Assumptions: - inputs are molecules Sample Usage: >>> from rdkit.VLib.NodeLib.SDSupply import SDSupplyNode >>> fileN = os.path.join(RDConfig.RDCodeDir,'VLib','NodeLib', 'test_data','NCI_aids.10.sdf') >>> suppl = SDSupplyNode(fileN) >>> filt = DupeFilter() >>> filt.AddParent(suppl) >>> ms = [x for x in filt] >>> len(ms) 10 >>> ms[0].GetProp("_Name") '48' >>> ms[1].GetProp("_Name") '78' >>> filt.reset() >>> filt.next().GetProp("_Name") '48'
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Inherited from Inherited from Inherited from |
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Inherited from |
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x.__init__(...) initializes x; see help(type(x)) for signature
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resets our iteration state
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