Dear RG members,
I am trying to install AMBER in parallel in one cluster having ifort compiler. I am getting the error MPIF90 command not found. I read the configure2 file in AmberTools/src, that tells I need to install serial first.
for searial
setenv AMBERHOME "amber path"
./configure -noX11 intel
make install
It is running perfectly.
How can I proceed to add MPI run.
Kindly suggest the next commands.
Should I hit
./configure -mpi intel
make install
or some other tricks.
I am failing each time with few errors.
Kindly share the complete commands after the searius installation steps.