Re: [AMBER] help identifying dihedral parameters for paracetemol using Antechamber

From: David A Case <>
Date: Tue, 3 May 2016 15:53:58 -0400

On Tue, May 03, 2016, conor parks wrote:
> However, in my prmtop file (values given in first email in this chain), the
> periodicity values are given as 1 and 2 (no negative sign). What happened
> to the negative sign on these periodicity values in my prmtop file?

Please see Negative values in a
parm.dat file have a special meaning.


AMBER mailing list
Received on Tue May 03 2016 - 13:00:02 PDT
Custom Search