From: Stefan H. <ste...@h-...> - 2012-11-07 14:28:54
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Hi OpenBabel users, Is there an easy way to read a complex structure as a molecule using openbabel (python-API) and to split it afterwards into different molecules (e.g., protein, ligand, cofactor,...) to handle/write it as different objects? Here, it would be helpful not loosing information like residue names what happens if you just copy atoms to a new molecule object. Thank you for your help! Best, Stefan |