Reply To: Loop modeling with ligand in the receptor

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December 15, 2010 at 8:44 am #4757
Anonymous

    With -extra_res_cen it gives me the error below. I get the same if I use -remodel no.

    protocols.looprelax: ==== Loop protocol: =================================================
    protocols.looprelax: remodel perturb_kic
    protocols.looprelax: intermedrelax no
    protocols.looprelax: refine refine_kic
    protocols.looprelax: relax fastrelax

    ERROR: unrecognized atom_type_name aroC
    ERROR:: Exit from: src/core/chemical/AtomTypeSet.hh line: 76