Hello,
Per a previous post on this list by Tyler (I'm having trouble locating it
right now), I think there's a license issue preventing sander.RISM to be
built, since it uses fftw which operates under the GPL -or- a paid
commercial license. The GPL (unlike the LGPL) requires that any software
that incorporates the source code of a GPLed project itself be open source,
which sander is not. (The LGPL does not have this restriction).
For this reason, RISM is only available in Amber through nab.
I hope this helps,
Jason
On Fri, Nov 12, 2010 at 12:40 PM, Magdalena Gruziel <M.Gruziel.icm.edu.pl>wrote:
>
> Hello,
>
> i'd like to test rism but it seems, i do not
> know how to congigure or compile the sources
> to get it.
> Whatever I try [also including XTRA_FLIBS and
> -rismmpi option for the parallel version] no
> sander.RISM/sander.MPI.RISM binaries get created.
>
> As I understood. rism1d binary is sth different
> than sander.RISM [the latter being for 3d-rism, yes?]
>
> Should it be perhaps compiled separately?
> does anyone know?
> i would be very grateful for any hints..
>
> best regards
> magdalena
>
>
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>
--
Jason M. Swails
Quantum Theory Project,
University of Florida
Ph.D. Graduate Student
352-392-4032
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Received on Fri Nov 12 2010 - 11:30:04 PST
