Re: [gmx-users] Re: Gromacs + GPU: Problems running dppc example in ftp://ftp.gromacs.org/pub/benchmarks/gmxbench-3.0.tar.gz

2011-01-27 Thread Carsten Kutzner
Hi Camilo, On Jan 27, 2011, at 7:19 AM, Camilo Andrés Jimenez Cruz wrote: Sorry, abrupt sending, the coulombtype is the same coulombtype = cut-off Is your cut-off actually 0.0 then? Carsten and constraints = all-bonds is the same. Any idea? 2011/1/27 Camilo

[gmx-users] Re: Gromacs + GPU: Problems running dppc example in ftp://ftp.gromacs.org/pub/benchmarks/gmxbench-3.0.tar.gz

2011-01-26 Thread Camilo Andrés Jimenez Cruz
Sorry, abrupt sending, the coulombtype is the same coulombtype = cut-off and constraints = all-bonds is the same. Any idea? 2011/1/27 Camilo Andrés Jimenez Cruz camilo.jimen...@gmail.com Hi all! I am trying to run the dppc example located in