Re: [AMBER] Building pmemd.cuda.MPI error in amber18

From: David Case <david.case.rutgers.edu>
Date: Fri, 29 Mar 2019 11:15:39 +0000

On Thu, Mar 28, 2019, Meng Wu wrote:
>
>
>mpif90 -DMPI -DBINTRAJ -DEMIL -DPUBFFT -DGNU_HACKS -O3
>-mtune=native -DCUDA -DGTI -DMPI -DMPICH_IGNORE_CXX_SEEK
>-I/home/install/amber18/include -c master_setup.F90
>master_setup.F90:120.30:
>
> double precision :: val
> 1
>Error: Symbol 'val' at (1) already has basic type of REAL

Which mpi version are you using? What is the result of typing "mpi
-show"? Be sure it is pointing to the same compiler as you have used
for non-mpi builds.

Probably also helpful to let us know what your fortran version is.

....thanks....dac


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Received on Fri Mar 29 2019 - 04:30:02 PDT
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