[gmx-users] About Compilation error in gromacs 4.6

Mark Abraham mark.j.abraham at gmail.com
Tue May 28 15:01:09 CEST 2013


The actual error message is higher up, but my guess would be your compiler
in 10.04 is too old to be useful. Per the installation instructions, you
will want the latest version of gcc you can get, and ones that came with
10.04 will very likely be wrong or slower than the latest ones.

Mark


On Tue, May 28, 2013 at 1:39 PM, vidhya sankar <scvsankar_agr at yahoo.com>wrote:

> Dear Justin Thank you for your Previous reply,
>                                                                     I have
> Downloaded gromacs 4.6
>
> I have configured well using the following command
> cmake .. -DCMAKE_INSTALL_PREFIX=/usr/local/gromacs4.6 -DGMX_DOUBLE=ON
> -DGMX_BINARY_SUFFIX=_d
>
> and when i Compile using make command
> I have got following error
> make[2]: ***
> [src/gmxlib/CMakeFiles/gmx.dir/nonbonded/nb_kernel_avx_128_fma_double/nb_kernel_ElecCSTab_VdwLJ_GeomW4P1_avx_128_fma_double.c.o]
> Error 1
> make[1]: *** [src/gmxlib/CMakeFiles/gmx.dir/all] Error 2
> make: *** [all] Error 2
>
> How to solve the error
> What  Dependencies should I install to solve This Error
>
> I Have installed gCC ,g++ compiler and fftw3.3 in My Ubuntu 10.04 OS
>
>   I have AMD 8 core processor
> Thanks In Advance
>
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