[gmx-users] my octane was divided into four parts

Dallas Warren dallas.warren at vcp.monash.edu.au
Sun Sep 21 23:58:01 CEST 2003


>firstly, and then I add water in the z direction. When i continued to 
>minimized the water+octane,my octane was divide into four separate parts.Why?

I would recommend that you get your hands on the latest version of VMD.  It 
now has the ability to add the repeating cell units in the +ve and -ve axis 
directions.  It can come in very handy for visualisation, particularly when 
there are aggregates involved or units that may be close to the boundary.

Catch ya,

Dr. Dallas Warren
Research Fellow
Department of Pharmaceutical Biology and Pharmacology
Victorian College of Pharmacy, Monash University
381 Royal Parade, Parkville VIC 3010
dallas.warren at vcp.monash.edu.au
+61 3 9903 9083
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