Date: Thu, 26 Sep 2002 08:37:15 -0700
From: "David A. Case"
Subject: Re: mm_pbsa and statistic program

On Thu, Sep 26, 2002, Pascal Bonnet wrote:

> 2) Also, having the average energies and the STD of the complex (AB),
> ligand (B) and the receptor (A), is it possible to calculate the STD of
> the interaction [AB-(A+B)] ?

If you used independent trajectories for A, B and complex, then standard
propagation of error formulas can be used to generate an estimate of the STD
of distribution of [AB - (A+B)].

..good luck...dac