Re: AMBER: Using antechamber without AMBER program

From: David A. Case <>
Date: Mon, 4 Feb 2008 13:46:00 -0800

On Mon, Feb 04, 2008, Surasak Chunsrivirot wrote:
> I'm completely new to AMBER and our lab doesn't have AMBER program yet. I want
> to use AMBER force fields to do simulation of small molecules, using CHARMM or
> NAMD software. I want to use antechamber to generate force fields for small
> molecules such as drugs, solvents, excipients and wondering if I can just use
> antechamber program to do that.

Yes, you can do that. One of the output options for antechamber is "charmm",
which may be helpful in your particular situation.


The AMBER Mail Reflector
To post, send mail to
To unsubscribe, send "unsubscribe amber" to
Received on Wed Feb 06 2008 - 06:07:21 PST
Custom Search