[gmx-users] fftw and gromacs..
Brian O'Brien
bobrien at ucalgary.ca
Wed Oct 11 15:31:13 CEST 2006
Hi... I read the FAQ on using gromacs with FFTW...
I set the LD_LIBRARY_PATH, yet when trying to make gromacs, at the ./
configure point, it still complains about not being able to find fftw
configure: error: Cannot find fftw3f library
ls /usr/local/lib/*fftw*
/usr/local/lib/libfftw.a /usr/local/lib/libfftw.la /usr/local/lib/
libfftw3.a /usr/local/lib/libfftw3.la /usr/local/lib/librfftw.a /
usr/local/lib/librfftw.la
I made and installed fftw by:
./configure
make
sudo make install
I have read something about setting flags for fftw but do not know
where to modify these flags...
help?
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