VMD-L Mailing List

From: Axel Kohlmeyer (akohlmey_at_gmail.com)
Date: Tue Jan 31 2012 - 07:25:02 CST

On Tue, Jan 31, 2012 at 7:01 AM, Ben Hall <benjamin.a.hall_at_ucl.ac.uk> wrote:
> I've been using the volmap tool to pick out areas of high water occupancy
> in MD simulations, and wondered if it was possible to link the specific
> value of an isosurface to a calculated density (ie 1 = 50 % occupancy)?

well, shouldn't a value of 0.5 be equivalent to 50% occupancy?
provided you don't use any other scaling, that is.

axel

>
> Thanks in advance
>
> Ben Hall
>
> --
> Dr Benjamin A Hall
> Centre for Computational Science, Department of Chemistry, UCL
> benjamin.a.hall_at_ucl.ac.uk
>
> 

-- 
Dr. Axel Kohlmeyer
akohlmey_at_gmail.com  http://goo.gl/1wk0
College of Science and Technology
Temple University, Philadelphia PA, USA.