[gmx-users] residues in force fields

[Mark Abraham]

Hi,

Those are for acetyl and N-methylamine chemical moieties. Those are often
used to cap peptide fragments to avoid zwitterions (both in simulation and
experiment).

Mark

On Sat, Jan 31, 2015 at 9:24 PM, shahab shariati <shahab.shariati at gmail.com>
wrote:

> Dear all
>
> I am a beginner in gromacs. I am studying manual and force fields.
>
> I have a question about 2 residue name in aminoacid.rtp file in force
> fields (for example, amber03).
>
> I want to know ACE and NME residues.
>
> Any help will highly appreciated.
> --
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