AMBER Archive (2002)

Subject: parallel sander?

From: Mark Hsieh (hsieh_at_abmaxis.com)
Date: Tue Apr 23 2002 - 14:31:55 CDT


Hi,

When I run amber 7 sander (mpich compiled) to minimize, I am able
to utilize two processors on my dual CPU workstation but when
I run sander to do dynamics, only one processor is utilized.
I am using SHAKE NTC=2 at NTB=1. Are there conditions where parallel
runs are not implemented under sander?

Mark