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
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Mon Nov 15 2010 - 19:00:03 PST