[gmx-users] ffamber94 with gromacs 4.0.3
Mark.Abraham at anu.edu.au
Tue Feb 23 22:59:28 CET 2010
On 24/02/2010 12:56 AM, Justin A. Lemkul wrote:
> Carla Jamous wrote:
>> please does anyone know if the ffamber94 force-field is compatible
>> with gromacs version 4.0?
>> Because I used to use it with gromacs 3.3.3 but now that I'm trying
>> with gromacs 4, I'm having some error messages.
> There is no problem at all using ffamber under Gromacs 4.0.x. If you
> want help, though, you'll have to provide a lot more information - what
> you're doing (command line) and what the exact error message(s) is (are).
...and do yourself a favour and update to GROMACS 4.0.7 - there have
been many bugs fixed since 4.0.3
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