Hi Amber Users,
I am experiencing a problem in installing Amber 14 with Amber15Tools with
mpi. Following is the error that I am getting while I was trying to
configure it with mpi
Error: FFTW configure returned 1
FFTW configure failed! Check the fftw3_config.log file
in the /home/prabir/SOFTWARE/AMBER/AMBER14/amber14/AmberTools/src
directory.
There was no problem for the installation of serial version. The server has
an installed openmpi 1.10.3. I have tried this both using ./configure -mpi
gnu and ./configure -openmp gnu. In both the cases, I got the similar
problem. Can anyone please suggest me how to fix this error?
Any suggestion would be appreciated.
Thank you,
Sincerely,
Prabir
*Prabir Khatua*
*Postdoctoral Research Associate*
*Department of Chemistry & Biochemistry*
*University of Oklahoma*
*Norman, Oklahoma 73019*
*U. S. A.*
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Received on Fri Feb 01 2019 - 11:30:02 PST
