[gmx-users] HB3 ATOM

[Mahdi Sobati Nezhad]

Yes. Now my problem is HG in residue CYS that I don't know rename to what!!!

On Mon, 3 Sep 2018 22:49 Justin Lemkul, <jalemkul at vt.edu> wrote:

>
>
> On 9/3/18 6:27 AM, Mahdi Sobati Nezhad wrote:
> > Hi
> > my pdb file named HB2 and HB3 but .rtp file in  my force field named
> HB1and
> > HB2. and so on error "atom HB3 in residue xxx was not found in rtp entry"
> > can I rename HB2 to HB1 and HB3 to HB2 ?
> > or any idea?!
> Have you tried it?
>
> -Justin
>
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