AMBER Archive (2009)

Subject: RE: [AMBER] What is the purpose to do the bond constraints?

From: Bill Ross (
Date: Mon May 18 2009 - 14:39:42 CDT

> What do the "bond constraints" mean?

The bond is held absolutely fixed, i.e. there is no potential term
and no oscillation ('restraints' = fixed with a potential, i.e.
allowing for some oscillation).


AMBER mailing list