[gmx-developers] fortran kernels

Christoph Junghans junghans at mpip-mainz.mpg.de
Wed Jul 21 17:27:53 CEST 2010

He there,

has somebody recently used the fortran kernels of the developer branch?
I made a small simulation, but the rdf is completely different from the 
one of the c-kernel simulation.

This is a power6 system and I used xlc_r /xlf_r to compile.
The power6 kernels do not even build (see bug #475).
The above problem appears in the normal fortran kernels.



Dipl.-Phys. Christoph Junghans
Max Planck Institute for Polymer Research
Theory Group
POBox 3148
D 55021 Mainz, Germany

Phone: +49 6131 379 335
Web: http://www.mpip-mainz.mpg.de/~junghans

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