[gmx-users] Visualizing the system
shima_arasteh2001 at yahoo.com
Sat Sep 22 08:44:12 CEST 2012
What you suggested, worked. I mean not resname POPC solved the problem. But I'd like to know why that problem happens?! I followed the steps of KALP15 exactly.
Anyway, thanks Peter.
----- Original Message -----
From: Peter C. Lai <pcl at uab.edu>
To: Discussion list for GROMACS users <gmx-users at gromacs.org>
Sent: Saturday, September 22, 2012 9:57 AM
Subject: Re: [gmx-users] Visualizing the system
This is a VMD question, but try using manual selections, like:
"not resname POPC and not resname SOL and not resname NA and not resname CL"
as a selection that doesn't show popc, water, and ions, for example.
I haven't had issues with VMD confusing what a protein is or not, so maybe
there is a residue ordering issue or something going on with the gro file?
On 2012-09-21 11:19:51PM -0700, Shima Arasteh wrote:
> In order to see a system of protein and lipids, I use VMD. I called system.gro something similar to what is produced in KALP15 in DPPC. When I load system.gro and select protein, one of lipids is loaded with it.
> I am wondering if it is a problem with my system.gro? Or something with the applied visualization tool?
> Thanks in advance.
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Peter C. Lai | University of Alabama-Birmingham
Programmer/Analyst | KAUL 752A
Genetics, Div. of Research | 705 South 20th Street
pcl at uab.edu | Birmingham AL 35294-4461
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