On 29/10/2010 5:52 PM, Anamika Awasthi wrote:
Dear friends,

i have installed gromacs 4.5-beta3 and fftw-3.2.8 on root, now when I am giving command ./configure --enable-threads, it is showing error: cannot find fftw3f library.

   please let me know, why this error is showing here?

Don't install beta software for 4.5 when 4.5.1 is already out.

Otherwise, have you followed the instructions here? http://www.gromacs.org/Downloads/Installation_Instructions

Mark
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