[gmx-users] What molecule generator should be used if using GROMOS Force Field?
Mark.Abraham at anu.edu.au
Tue May 22 15:25:58 CEST 2007
Stéphane Téletchéa wrote:
> WU Yanbin a écrit :
>> Hi, Everyone,
>> If I use GROMOS force field, what molecule generator, specially the
>> topology generation, should I use (just like for gromacs force field,
>> there is PRODRG)?
>> I have tried to convert gromacs topology to GROMOS topology. The
>> problem is that some atom type like "CS2" in PEO does noe exist in
>> GROMOS force field. And GROMOS manual can not be downloaded for free.
>> Where can I find description for each atom type in GROMOS? Any
>> suggestions? Thanks in advance.
>> Yours Sincerely,
>> WU Yanbin
> The manual is downloadable for free:
> You can even have a look at it online:
Actually Stephane, Wu referred to the *GROMOS* manual not being free,
which is indeed true.
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