[gmx-users] grompp error
K.A.Feenstra
k.a.feenstra at chem.rug.nl
Fri Dec 21 09:41:53 CET 2001
Daan van Aalten wrote:
>
> Hi Nusrat
>
> PRODRG topologies only work with the standard ffgmx forcefield....
Which is actually quite unfortunate, since we now regard the ffG43*
forcefields as standards. Is there any hope of having this as an option
to PRODRG, or if you don't want to add options, I would suggest to
switch completely to the ffG43 in stead of ffgmx... The ffG43 is a new
version of the ff, which is really an improvement over the old one...
--
Groetjes,
Anton
_____________ _____________________________________________________
| | Anton Feenstra Dept. of Biophysical Chemistry |
| _ _ ___,| K.A.Feenstra at chem.rug.nl University of Groningen |
| / \ / \'| | | Tel +31 50 363 4327 Nijenborgh 4 |
|( | )| | | Fax +31 50 363 4800 9747 AG Groningen |
| \_/ \_/ | | | http://md.chem.rug.nl/~anton The Netherlands |
| | "The Wheels On the Bus Go Round and Round" (J. Richm|
|_____________|_____________________________________________________|
More information about the gromacs.org_gmx-users
mailing list