SLIM H.A. wrote:
Justin,
Thanks, I am not familiar with gromacs, where could I find specific
information about the differences between 4.0 and earlier versions.
The manual and the -h flag of every command work pretty well, along with release
notes:
http://www.gromacs.org/content/view/181/132/
and revision history:
http://www.gromacs.org/content/category/4/58/132/
All of the above can be found in the "Documentation" section of the Gromacs
website.
-Justin
Thanks again
Henk
-----Original Message-----
From: [EMAIL PROTECTED]
[mailto:[EMAIL PROTECTED] On Behalf Of Justin A. Lemkul
Sent: 28 November 2008 18:18
To: Discussion list for GROMACS users
Subject: Re: [gmx-users] gromacs 4.0 -np parameter?
SLIM H.A. wrote:
I have recenly built gromacs 4.0 using MPI, however grompp
-h does not
include a -np option. Does this indicate that it actually was not
built for multiprocessor use?
No, it is simply not necessary to pre-process with -np anymore.
-Justin
Thanks
Henk Slim
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--
========================================
Justin A. Lemkul
Graduate Research Assistant
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin
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--
========================================
Justin A. Lemkul
Graduate Research Assistant
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin
========================================
--
========================================
Justin A. Lemkul
Graduate Research Assistant
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin
========================================
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