[AMBER] Amber compilation problems

From: Fabrício Bracht <fabracht1.gmail.com>
Date: Thu, 6 Oct 2016 17:01:34 -0300

Recently our cluster has gone through some updates and I had to recompile
amber16. I am using intel compilers 2015 (icc version 15.0) and intel mpi.
The serial compilation works, but when I try ./configure -intelmpi intel, I
get the an error saying that I should check AmberTools/src/fftw3_config.log.
The last 5 lines of fftw3_config.log are.

checking for mpicc... mpiicc
checking for MPI_Init... no
checking for MPI_Init in -lmpi... no
checking for MPI_Init in -lmpich... no
configure: error: could not find mpi library for --enable-mpi

Any idea what the problem might be?

AMBER mailing list
Received on Thu Oct 06 2016 - 13:30:03 PDT
Custom Search