[gmx-users] (no subject)

[Daan van Aalten]

try the PRODRG server at

http://davapc1.bioch.dundee.ac.uk/prodrg

Daan

On Tue, 8 Feb 2005, Aina Quintilla wrote:

> dear gromacs' users,
>
> i am trying to attaach a dye to my protein.
> the formula is C31H40N4O3F2B.. the atom B is not even in the list of the
>  atoms types gromacs is dealing with.. how can a define a topology for such a
>  ligand?
>
> thank you very much in advance
>
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