dope_loopmodel and TER
Hi, I would like to use the dope_loopmodel but an error occurs during the job with the message : "Atom 3928 (type 77) has GB/SA radius 0.0000". In my pdb file generated by modeller the atom 3928 refers to TER (not really an atom...). May I change the solv.lib file adding a new line for TER atom ? Thanks, Lionel Ducassou
On 9/27/10 8:22 AM, Lionel Ducassou wrote: > I would like to use the dope_loopmodel but an error occurs during the > job with the message : "Atom 3928 (type 77) has GB/SA radius 0.0000".
Atom type 77 is FE; see the MASS lines in modlib/top_heav.lib.
> In my pdb file generated by modeller the atom 3928 refers to TER (not > really an atom...).
Like you say, TER is not an atom, so you must be looking at the wrong line in your PDB file.
Ben Webb, Modeller Caretaker
participants (2)
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Lionel Ducassou
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Modeller Caretaker