[gmx-users] Please test the new Gromacs-4.5!

Florian Dommert dommert at icp.uni-stuttgart.de
Thu Sep 2 15:47:22 CEST 2010


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On 09/02/2010 03:39 PM, Rossen Apostolov wrote:
>  On 9/2/10 3:21 PM, Florian Dommert wrote:
> On 09/02/2010 02:56 PM, Rossen Apostolov wrote:
>>>>   Hi Florian,
>>>>
>>>> Thanks a lot! That was another miss. I have re-packaged 4.5.1 :) So if
>>>> someone has downloaded it in the last couple of hours, please
>>>> re-download it again (I know it's not the right thing to do with
>>>> releases though :-) )
>>>>
>>>> Rossen
> Hi,
> 
>   I downloaded the source again from www.gromacs.org, but unfortunately
> the same error messages occur, while building works fine.
> 
> Only the share directory is created and then the installation process
> stops.
> 
>> Sorry, can you try downloading again:)
> 

Thanks Rossen, everything works fine now with CMake :)

Compilation gives just 4 warnings for g_hbond due to uninitialized
variables.

/Flo

>> Rossen
> /Flo
> 
>>>>> Hi Rossen,
>>>>>
>>>>>    thanks for this very helpful information. Compilation works fine
>>>>> now.
>>>>> However when I try to install with
>>>>>
>>>>>    make install
>>>>>
>>>>> I get following error message:
>>>>>
>>>>>
>>>>> CMake Error at share/cmake_install.cmake:40 (FILE):
>>>>>     file INSTALL cannot find
>>>>>
>>>>> "/home/dommert/Downloads/gromacs-4.5.1/share/template/CMakeLists.txt.template".
>>>>>
>>>>>
>>>>> Call Stack (most recent call first):
>>>>>     cmake_install.cmake:37 (INCLUDE)
>>>>>
>>>>>
>>>>> /Flo
> 
> -- Florian Dommert
> Dipl.-Phys.
> 
> Institute for Computational Physics
> 
> University Stuttgart
> 
> Pfaffenwaldring 27
> 70569 Stuttgart
> 
> Phone: +49(0)711/685-6-3613
> Fax:   +49-(0)711/685-6-3658
> 
> EMail: dommert at icp.uni-stuttgart.de
> Home: http://www.icp.uni-stuttgart.de/~icp/Florian_Dommert

- -- 
Florian Dommert
Dipl.-Phys.

Institute for Computational Physics

University Stuttgart

Pfaffenwaldring 27
70569 Stuttgart

Phone: +49(0)711/685-6-3613
Fax:   +49-(0)711/685-6-3658

EMail: dommert at icp.uni-stuttgart.de
Home: http://www.icp.uni-stuttgart.de/~icp/Florian_Dommert
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