Re: [AMBER] autoimage for grid analysis with cpptraj

From: David A Case <david.case.rutgers.edu>
Date: Tue, 22 Sep 2020 08:45:02 -0400

On Tue, Sep 22, 2020, Gustaf Olsson wrote:
>
> autoimage :1-11 origin familiar

>The original cell is not a truncated octahedron.

Dan is probably busy, so I'll try to answer: I pretty sure that
"familiar" is just ignored if you don't have a truncated octahedron.
(You might inspct the cpptraj log file to see if there is any indication
there of what is happening.)

...dac

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Received on Tue Sep 22 2020 - 06:00:03 PDT
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