Re: amber-developers: Extra Points Calculation

From: Volodymyr Babin <vbabin.ncsu.edu>
Date: Tue, 11 Nov 2008 15:25:03 -0500 (EST)

Thank you. It runs okay with 4/8/16/32 threads (4 physical
cpus) on my desktop machine (ifort+mpich-ch_shmem). Will try
it over network later (have to leave for a few hours now).

Volodymyr

On Tue, November 11, 2008 15:14, Ilyas Yildirim wrote:
> There you go. Run the csh script in the directory. Thanks.
>
> On Tue, 11 Nov 2008, Volodymyr Babin wrote:
>
>> You have forgotten the prmtop/inpcrd/etc files. Ideally
>> I would expect a tar-gziped directory with 'runme'
>> script (and everything it needs) inside.
>>
>> Thank you,
>> Volodymyr
>>
>>
>
> --
> Ilyas Yildirim, Ph.D.
> ---------------------------------------------------------------
> = Hutchison Hall B#10 - Department of Chemistry =
> = - University of Rochester =
> = 585-275-6766 (office) - =
> = http://www.pas.rochester.edu/~yildirim/ =
> ---------------------------------------------------------------
>
Received on Fri Dec 05 2008 - 14:30:01 PST
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