AMBER Archive (2009)

Subject: [AMBER] why should one restrain the position of the counterions?

From: Jose Borreguero (
Date: Mon Sep 28 2009 - 13:28:20 CDT

Is it to prevent the counterions migrating to the interior of the protein,
or to prevent them to get too close to the charged residues in the surface?
And why would this be undesirable if it is a physical effect, after all?

AMBER mailing list