[gmx-users] How can I determine how Gromacs was compiled?

[Szilárd Páll]

On Wed, Apr 15, 2015 at 7:32 PM, Mirco Wahab
<mirco.wahab at chemie.tu-freiberg.de> wrote:
> On 15.04.2015 18:41, Andrew DeYoung wrote:
>>
>> Hi,
>>
>> I'm running Gromacs 4.5.5.  Is there a way to determine how Gromacs was
>> compiled on my system?  I would like to know whether the person who
>> compiled Gromacs used gcc or icc (both compilers are available and were
>> presumably available when the compilation occurred) and, if possible, what
>> version of FFTW they used.  Is there a file or a command that has this
>> information?
>
>
> what does:
>
>   mdrun | less md.log
>
> (in any directroy) say?

AFAIR we added the "-version" information to the log (and extended it)
in v4.6, so that will likely not help.

>
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