Re: [AMBER] ptraj.MPI

From: David A Case <case.biomaps.rutgers.edu>
Date: Tue, 31 Jan 2012 08:03:27 -0500

On Tue, Jan 31, 2012, Sel Ercan wrote:

> I have installed amber11 parallel with success. But there is not
> parallel version of ptraj in bin directory while sander.MPI and
> pmemd.MPI exist.

What commands did you use to do the installation. Note that do get parallel
versions of AmberTools, you need to go to amber11/AmberTools/src and type
"make parallel" there (as well as in amber11/src). This will be simplified in
the next release.

....dac


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Received on Tue Jan 31 2012 - 05:30:04 PST
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