On Thu, Mar 3, 2016 at 3:10 AM, chemjxn <chemjxn.126.com> wrote:
> Hello,
> I calculated some complexes. Then I want to perform the MM-GB/SA
> calculation. When I perform "./gbsa.sh" order, it turns up the same error
> (shown in mmgbsa_error.jpg) for all my complexes. I don't know how to solve
> this problem. Please help me. Thank you very much.
>
Were there any error messages printed in the output before the traceback
started? Look for an error message in _MMPBSA_complex_gb.mdout.0 and put
the error message in that file into Google to see if there are any
suggestions.
HTH,
Jason
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Received on Thu Mar 03 2016 - 04:00:03 PST
