[gmx-users] reg mopac.gromacs installations

Justin A. Lemkul jalemkul at vt.edu
Tue Jul 28 13:23:06 CEST 2009

vidhya sankar wrote:
> dear gmx user
> thanks in advance 
> i have sucessfully installed the folowing version of fft files from src 
> fftw-3.2.2
> but when i install the gromacs-4.0.5 by giving the following command
> LIBS=-lmopac LDFLAGS=-L/usr/lical/lib ./configure --with-qmmm-mopac

This command is not only improperly ordered, but it contains a typo in the LDFLAGS.


> i got the error as follows
> *configure: error: Cannot find fftw3 library *
>  if any one of you know let me know
> is there is any problem in the path settings? please help me to install 
> successfully i am  waiting for your reply soon
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Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080


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