AMBER Archive (2006)

Subject: Re: AMBER: Umbrella sampling

From: David A. Case (case_at_scripps.edu)
Date: Fri Apr 07 2006 - 15:56:48 CDT

On Fri, Apr 07, 2006, venditti2_at_unisi.it wrote:

> in teh exemple reported on the Amber8 manual (pag 138) in which units is
> reported the force constant?

The force constant is twice rk2, which is in units of kcal/mol-radian.

See the expanded explanation on p. 159 of the Amber 9 Users' manual (available
at http://amber.scripps.edu).

....dac

-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber_at_scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo_at_scripps.edu