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From: Seth H. <se...@gm...> - 2010-11-09 03:13:54
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Hi all, I feel I should know this one. I have a program looping through structures and bringing each small molecule into a single multi-state object so I can tab through the states. I do: create all_lig, this_ligand, 1, 1 then go on to the next one: create all_lig, next_ligand, 1, 2 and so on.... however, the bonds get all messed up, presumably with atom names confused? I tried issuing a "rebuild all_lig" in between adding but that didn't seem to help. What am I missing? Thanks, Seth |