On Thu, Sep 11, 2008, Carlos Simmerling wrote:
> check the archives for ff03 npro
Yes, but this needs to get fixed as soon as we can. cc-ing to yong,
since he may not read this list.
...dac
>
> On Thu, Sep 11, 2008 at 11:23 AM, Wei Zhang <zgjzweig.gmail.com> wrote:
> > Hi All,
> >
> > I just noticed that in all_aminont03.lib the total charge of residue
> > "NPRO" is -0.9026
> > not -1, and it seems to be the only one having this problem. All other
> > residues' total
> > charges are integers, including PRO (0) and CPRO (-1).
> >
Received on Fri Sep 12 2008 - 03:07:09 PDT
