Re: [AMBER-Developers] near-final testing

From: David A. Case <case.biomaps.rutgers.edu>
Date: Tue, 13 Apr 2010 22:51:59 -0400

On Tue, Apr 13, 2010, Tyler Luchko wrote:
>
>
> The attached patch should fix the problem. I'm surprised that this only shows up with MPICH. Basically, I was passing 0 instead of 0d0 to a BLAS subroutine.
>
> BTW, if anyone is willing/interested in testing RISM in NAB with MPICH the library to link to is libfmpich.a:
>
> export XTRA_FLIBS=-lfmpich

I added a comment about this to the configure script....thx...dac


_______________________________________________
AMBER-Developers mailing list
AMBER-Developers.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber-developers
Received on Tue Apr 13 2010 - 20:00:04 PDT
Custom Search