Sorry, this meant ff02ep+pol+parm99EP+POL3BOX ...
yong
> -----Original Message-----
> From: owner-amber-developers.scripps.edu
> [mailto:owner-amber-developers.scripps.edu] On Behalf Of Yong Duan
> Sent: Sunday, November 16, 2003 6:46 PM
> To: amber-developers.scripps.edu
> Subject: amber-developers: Ff02 ep pol/parm99EP on
> ace-ala4-nme in POL3BOX
>
>
>
> I have a preliminary analysis of a simulation on ala4 in POL3BOX for 5
> ns, using ff02EP/parm99EP. The simulation will be continued
> to 10ns but
> I doubt longer simulation will qualitatively change the picture.
>
> The main-chain phi-psi distribution is biased toward the
> region close to
> (30<phi<60 and -60 <psi< 60). This is not a region that is typically
> observed in either PDB or other simulations. Those of you who want to
> take a look at the data, please let me know. The file is not too big
> (0.5MB). But it has to be sent by attachment.
>
> yong
>
>
>
Received on Wed Apr 05 2006 - 23:50:06 PDT
