VMD-L Mailing List

From: sfrickenhaus (Stephan.Frickenhaus_at_awi.de)
Date: Mon Jul 30 2007 - 04:53:40 CDT

Hello,

I find problems with the PBC in the gofr-gui analysis. It simply does
something wrong in the vicinity of 0.75 A;
I set {a b c} for my mol by hand to the box dioemsnsions before.{gamma
beta delta} are {90 90 90}.
When I set "Update Selections" it seems OK.
  Any idea why this is so?

Stephan 

-- 
Prof. Dr. Stephan Frickenhaus
 Alfred-Wegener-Institut f. Polar- u. Meeresforschung
 Am Handelshafen 12
 27570 Bremerhaven
 stephan.frickenhaus_at_awi.de
 0471-4831-1179
 0151-1741 1631
 Hochschule Bremerhaven - Bio-Analytik, FB 1
 An der Karlstadt 8
 27568 Bremerhaven
 0471-4823-525
 0151-1741 1631