[gmx-users] About Compilation error in gromacs 4.6

Mark Abraham mark.j.abraham at gmail.com
Tue May 28 19:01:44 CEST 2013


That'll likely work, but whether Vidhya wants to use it depends whether he
cares about his simulation performance on this machine.

Mark


On Tue, May 28, 2013 at 4:05 PM, Mirco Wahab <
mirco.wahab at chemie.tu-freiberg.de> wrote:

> On 28.05.2013 13:39, vidhya sankar wrote:
>
>> cmake .. -DCMAKE_INSTALL_PREFIX=/usr/**local/gromacs4.6 -DGMX_DOUBLE=ON
>> -DGMX_BINARY_SUFFIX=_d
>>
>
> please try
>
> cmake ..  -DGMX_CPU_ACCELERATION=SSE4.1 -DCMAKE_INSTALL_PREFIX=/usr/**local/gromacs4.6
> -DGMX_DOUBLE=ON -DGMX_BINARY_SUFFIX=_d
>
> I remember to have encountered a problem with older gccs and AVX.
>
> M.
>
>
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