[gmx-users] (no subject)

Daan van Aalten vdava at davapc1.bioch.dundee.ac.uk
Wed Feb 9 09:46:21 CET 2005

try the PRODRG server at



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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