Re: [AMBER] Sander with restrained atoms

From: case <case.biomaps.rutgers.edu>
Date: Mon, 15 Nov 2010 21:52:16 -0500

On Mon, Nov 15, 2010, Dian Jiao wrote:
>
> It seems it is having problem reading the number of atoms from the refc
> file, THe refc file I used has the same format as restrt, which looks like
> this:
>
> %VERSION VERSION_STAMP = V0001.000 DATE = 11/10/10 22:36:28
> %FLAG TITLE
> %FORMAT(a)

What you show is the beginning of a prmtop file, not a restart file. Make
sure the refc file is indeed what it should be.

...dac


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Received on Mon Nov 15 2010 - 19:00:03 PST
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