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InviteWorkflow Entry: Determine the Maximum Common SubStructure (MCSS)
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 Version 1
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Version created on:
23/10/09 @ 12:01:43
by:
Egon Willighagen
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Title: Determine the Maximum Common SubStructure (MCSS)
Type: Bioclipse Scripting Language
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Description
BSL script to determine the maximum common substructure (MCSS) of a list of molecules and opens this in a JChemPaint editor.
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Non-Information Resource URI: http://www.myexperiment.org/workflows/934
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Looks intresting. You can also use new java.util.ArrayList() instead of cdk.createMoleculeList. But I am not sure that is clearer or shorter...