[discuss ifpsc] Re: Forcefield database proposal resulting from our
- From: IFPSC <admin@xxxxxxxxxxxxxxxxxxx>
- To: discuss-ifpsc@xxxxxxxxxxxxx
- Date: Wed, 12 Sep 2007 17:57:43 -0400
Forwarding this to the discuss-IFPSC list so it will be in the archives
---------- Forwarded message ----------
From: Raymond Mountain
Date: Aug 13, 2007 11:47 AM
Subject: [ifpsc] Re: Forcefield database proposal resulting from our
To: ifpsc@xxxxxxxxxxxxx
I tend to support Jonathan's view of how such a potential parameter
site might operate.
Something that is missing is something about the limits for a given
potential parameter set--properties and states of the system should be
clearly stated. If not, the old expression GIGO will apply for the
uninitiated user.
Ray
========================================================
The Industrial Fluid Properties Simulation Collective is an international
collaboration between industry, academia, and national labs aimed facilitating
and promoting the use of molecular simulation methods for the prediction of
fluid properties.
discuss-ifpsc@xxxxxxxxxxxxx is an email list for discussing issues related to
the Industrial Fluid Properties Simulation Collective...fluidproperties.org
If you are not subscribed, you can do so by sending email to
discuss-ifpsc-request@xxxxxxxxxxxxx with 'subscribe' in the Subject field
You can unsubscribe by sending email to discuss-ifpsc-request@xxxxxxxxxxxxx
with 'unsubscribe' in the Subject.
Online, searchable archives of this list are available at
//www.freelists.org/archives/discuss-ifpsc
Other related posts:
