Hi Nur,
If you'd searched for "defaults directive" and included my name ;) you'd found:
http://www.gromacs.org/pipermail/gmx-users/2007-March/026109.html
http://www.gromacs.org/pipermail/gmx-users/2006-February/019673.html
By the way, it's ffgmx not ffgnx/ffgnv.
Cheers,
Tsjerk
On 4/26/07, nur avneet <[EMAIL PROTECTED]> wrote:
Dear all
I am sorry...but i tried all suggestions to start the run of the lipid
bilayre...but failed.
i looked into the mailing list and found some options. one of the mail said
to remove the 1 from the [defaults] 1 1, column in the lipid.itp, but as
i do say it gives an error saying "Atomtype CA not found"
Another mail says to copy the lipid.itp file to the ffgnx.itp file, but that
too does not work. I added the line include "lipid.itp"...in the ffgnx.itp
file but it gave the same error ie "found a second defaults directive.." and
again if i remove the 1 it says atom CA not found.
I also tried copying the contents of the lipid.itp file to the ffgnv.itp
file but the same error persisits...
I am sorry for bothering you with a problem thats been discussed so many
times but i am helpless...
Please guide me
regrads
nur
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Tsjerk A. Wassenaar, Ph.D.
Junior UD (post-doc)
Biomolecular NMR, Bijvoet Center
Utrecht University
Padualaan 8
3584 CH Utrecht
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