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.
....dac
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Received on Wed Feb 06 2008 - 06:07:21 PST
