[gmx-users] Guidance on how to install Gromacs-5.0-beta2

Yogendra Ramtirtha ramtirtha.yogendra at gmail.com
Fri Feb 21 19:29:26 CET 2014


Hello,
Sorry to disturb you but can you please elaborate, since I tried the
modified command but still it gives similar error as before.


On Fri, Feb 21, 2014 at 10:49 PM, Yogendra Ramtirtha <
ramtirtha.yogendra at gmail.com> wrote:

> Thanks a lot I will try and let you know.
>
>
> On Fri, Feb 21, 2014 at 4:46 PM, Pavan Kumar <kumar.pavan006 at gmail.com>wrote:
>
>> Hello Yogendra,
>>
>> Remove "-DGMX_BUILD_OWN_FFTW=ON" argument and add
>> "CMAKE_PREFIX_PATH=/path/to/fftw"
>>
>> I hope it works
>>
>>
>> On Fri, Feb 21, 2014 at 4:31 PM, Yogendra Ramtirtha <
>> ramtirtha.yogendra at gmail.com> wrote:
>>
>> > Hello,
>> > Actually, I am trying to install Gromacs-5.0-beta2 on my systemwhich has
>> > Ubuntu 12.04.
>> > Everything went fine untill the make command which gives me the
>> following
>> > error -
>> >
>> > ( [  0%] Performing download step (verify and extract) for 'fftwBuild'
>> > -- verifying file...
>> >      file='http:/www.fftw.org/fftw-3.3.3.tar.gz'
>> > -- verifying file... warning: did not verify file - no URL_HASH
>> specified?
>> > -- extracting...
>> >
>> >
>> >
>>  src='/home/yogendra/Desktop/gromacs-5.0-beta2/build/src/contrib/fftw/fftwBuild-prefix/src/http:/
>> > www.fftw.org/fftw-3.3.3.tar.gz'
>> >
>> >
>> >
>>  dst='/home/yogendra/Desktop/gromacs-5.0-beta2/build/src/contrib/fftw/fftwBuild-prefix/src/fftwBuild'
>> > CMake Error at fftwBuild-stamp/extract-fftwBuild.cmake:11 (message):
>> >   error: file to extract does not exist:
>> >
>> >
>> >
>> '/home/yogendra/Desktop/gromacs-5.0-beta2/build/src/contrib/fftw/fftwBuild-prefix/src/http:/
>> > www.fftw.org/fftw-3.3.3.tar.gz'
>> >
>> >
>> > make[2]: ***
>> >
>> [src/contrib/fftw/fftwBuild-prefix/src/fftwBuild-stamp/fftwBuild-download]
>> > Error 1
>> > make[1]: *** [src/contrib/fftw/CMakeFiles/fftwBuild.dir/all] Error 2
>> > make: *** [all] Error 2 )
>> >
>> > To deal with this error, I manually installed fftw-3.3.3 on my desktop
>> but
>> > the major hurdle now is that I don't know how to proceed with Gromacs
>> > installation.
>> > Please can anyone guide me, I need help as Gromacs is a part of my
>> academic
>> > work. ( I am a graduate student of biotechnology. )
>> > --
>> > Gromacs Users mailing list
>> >
>> > * Please search the archive at
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>> > posting!
>> >
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>> >
>>
>>
>>
>> --
>> Thanks & Regards,
>> Pavan Kumar
>> Project Engineer
>> CDAC -KP
>> Ph +91-7676367646
>> --
>> Gromacs Users mailing list
>>
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>> posting!
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>
>


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