Hi,
The file formats in Amber 14 are fully compatible with programs from Amber
12 and vice versa. Trajectory corruption is a separate issue which can be
caused by several things, for example your run crashes in the middle of
writing a frame, or the underlying filesystem you are running on has
issues. In short, there should be no problems with compatibility.
-Dan
On Wed, Jul 9, 2014 at 10:51 AM, Brittany Boykin <
bzb0031.tigermail.auburn.edu> wrote:
>
> Hello,
>
>
> I am using Amber12 to run minimization and equilibration scripts but I
> switch to using Amber14 for production (MD/aMD). By doing this, will this
> cause a problem in the near future when running analysis, because not
> staying consistent? I did so happen to run into a problem when running
> analysis, certain frames are corrupt, is this issue stated above the
> corporate?
>
>
> Please help if you can. Thanks
>
>
> Brittany Boykin
> Graduate Student
> Auburn University
> Acevedo Research Lab Group
> Department of Chemistry and Biochemistry
> bzb0031.tigermail.auburn.edu
> (404)545.1036
> _______________________________________________
> AMBER mailing list
> AMBER.ambermd.org
> http://lists.ambermd.org/mailman/listinfo/amber
>
--
-------------------------
Daniel R. Roe, PhD
Department of Medicinal Chemistry
University of Utah
30 South 2000 East, Room 201
Salt Lake City, UT 84112-5820
http://home.chpc.utah.edu/~cheatham/
(801) 587-9652
(801) 585-6208 (Fax)
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Wed Jul 09 2014 - 10:30:02 PDT
