Subject: Software for distance geometry calculations

From: "David Clark" <David.Clark*at*ArgentaDiscovery.com>
Date: Thu, 27 May 2004 14:45:08 +0100

Hi 

Does anyone know of any freely available/open source software for
distance geometry calculations for small molecules?

I'm particularly interested in the initial set up of distance bounds
and then the smoothing of them using the triangle (and possibly
tetrangle) inequalities.

Many thanks
David Clark