AMBER Archive (2008)

Subject: Re: AMBER: problem bull linux compiling

From: Gustavo Seabra (gustavo.seabra_at_gmail.com)
Date: Tue Feb 26 2008 - 11:18:27 CST

> >> All was ok on last Linux bull platform (BAS) but now, whith the new os
> >> update, we have a error message when i launch 'make parallel' (make
> >> serial is ok):
> >>
> >
> > What did change with this update? Was your MPI implementation
> > (re)compiled with the same compiler you are using for Amber?
> yes it's the same compiler, but we have a new version of mpi released by
> Bull, our linux is like a redhat
>
> is it a mpi problem ?

Not sure, but usually you need the MPI to be compiled with the same
version of compiler used to compile sander. If your MPI version
changed, check if it was built with the same compiler you are using.

BTW, did you 'make clean' before doing 'make parallel' ?

Gustavo.
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