[gmx-users] SEP and HO atom type

[Anton Feenstra]

Luciane Vieira de Mello wrote:
[...]
> I am not sure if I am checking the right file:
> ffG43a1nb.itp
> where I tried to add the HO atomtype from ffgmx2nb.itp, including the
> pairtypes.

There is also a .atp file (for Atom TyPes), but IIRC that is only
used by pdb2gmx and not grompp... ;-(


-- 
Groetjes,

Anton
  ________ ___________________________________________________________
|        | Anton Feenstra                                            |
| .      | Dept. of Pharmacochemistry - Vrije Universiteit Amsterdam |
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