Hi Dan,
'-rismmpi' is a typo in the manual. It should be just '-rism'. E.g.,
./configure -mpi -rism gnu
The '-rism' flag is described by ./configure -help.
Tyler
On 2012-07-25, at 3:07 AM, Daniel Sindhikara wrote:
> Hi,
> According to the ambertools12 manual, to use 3DRISM with mpi, you should
> run the command:
> *./configure -mpi -rismmpi gnu*
>
> But my system gives
> ___
> *./configure -mpi -rismmpi gnu
> Checking for updates...
> AmberTools12 is up to date
> Amber12 is up to date
>
> Error: unknown flag: -rismmpi
> Type './configure -help' for options.
> Configure failed due to the errors above!*
> ___
>
> -rismmpi does not appear in the list of options in ./configure -help
>
> If I try to run a program using 3DRISM in nab compiled with mpinab, I get
> the message:
> *Error: 3D-RISM not installed. Please recompile with -rismmpi.*
>
>
> Is mpi for RISM not available in Ambertools12?
>
> -Dan
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________________________________________________________________
Tyler Luchko
Postdoctoral Associate
Case Group
BioMaPS Institute
Rutgers University
Piscataway, New Jersey
tluchko.rutgers.edu
848-445-5239
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Received on Wed Jul 25 2012 - 06:30:03 PDT
