Re: [AMBER] Angle restrained minimization

From: David A Case <>
Date: Wed, 25 Apr 2012 12:41:29 -0400

On Wed, Apr 25, 2012, Ashutosh Shandilya wrote:

> There are several restrained minimization in amber such as positional
> restrain, dihedral restrain, watson-crick restrain and putting all restrain
> together. My question is can we do minimization of protein using only angle
> restrained. If there is such an option please suggest the input file for
> that.

Please see Section 6.1 of the Amber12 Reference Manual: "Distance, angle and
torsional restraints". (Similar location in earlier versions).


AMBER mailing list
Received on Wed Apr 25 2012 - 10:00:02 PDT
Custom Search