AMBER Archive (2009)

Subject: Re: [AMBER] Max filename length in Sander?

From: David A. Case (case_at_biomaps.rutgers.edu)
Date: Mon Jun 08 2009 - 07:28:41 CDT

On Mon, Jun 08, 2009, Paul Mortenson wrote:
>
> it seems that when periodic boundary conditions are turned on, the
> maximum filename length for the inpcrd file is 80 characters.

The relevant code is the length of "arg" in mdfil.f. You can probably
increase that to 256 if you want (not tested). I don't see what this has to
do with periodic boundary conditions, though.

Workaround is to create links for long file names.

....dac

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