[gmx-users] Re: MOPAC gromacs mdreun error (vidhya sankar)

Vitaly Chaban vvchaban at gmail.com
Tue Dec 7 01:10:09 CET 2010


> Subject: [gmx-users] MOPAC gromacs mdreun error (vidhya sankar)
> To: gmx-users at gromacs.org
> Message-ID: <665887.73042.qm at web95501.mail.in.yahoo.com>
> Content-Type: text/plain; charset="iso-8859-1"
>
> Dear Gerrit sir,
>               Thank you for your atonce reply
> my mopac stand alone binary works well  i have tested using ./run_mopac7 tests/force
> but mdrun is not properly linked aganist libmopac.a
>  i am using the following command to  configure
> ./configure --disable-float --without-qmmm-mopac CPPFLAGS=-DUSE_MOPAC LIBS=-lmopac LDFLAGS=-L/usr/local/lib
> if i use --with-qmmm-mopac i end in  make error (compilation  error)
>  also how to check how to check the link of mdrun aganist libmopac.a  is there is any command for this?
> i am expecting your precious reply thanks in advance


It'd be great if somebody could ban this spammer...

Dr. Vitaly V. Chaban
Rochester, U.S.A.



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