[gmx-developers] real-time GROMACS visualization

Tommy Carstensen tc at stud.ku.dk
Thu Jun 16 11:35:56 CEST 2005


Anton, can you send a link to a picture of the '3D-workbench' in operation?

Tommy

-----Original Message-----
From: gmx-developers-bounces at gromacs.org
[mailto:gmx-developers-bounces at gromacs.org] On Behalf Of Anton Feenstra
Sent: 16. juni 2005 08:52
To: Discussion list for GROMACS development
Subject: Re: [gmx-developers] real-time GROMACS visualization

Marc Baaden wrote:
[...snip.interesting.preamble.snip...]
> In the best case scenario an interactive exploration would already show a
> rough feature that could then be confirmed and analysed in detail in a
> full MD simulation. This will depend on how subtle/robust the feature is
> against approximations and simplifications which are obviously needed for
> the interactive approach.
> 
> Do I have a point ?

Well, in any case I can confirm you are not the only one.

I know that at the Technical U of Delft, they have a spiffy 
'3D-workbench' (back-projected 3D crystal-eyes, large enough for 3-4 
people to stand at) setup, which they linked to 'interactive' 
simulations with Gromacs. I'm not sure at what level they interfaced, 
but it must be library-based. I've seen it work, it looks magnificent 
and, indeed, there is a high level of intuitive feel to it. It comes 
with a '3D-pointer' that you can use to drag atoms, molecules, etc.


-- 
Groetjes,

Anton

* NOTE: New Phone & Fax numbers (below) *

  _____________ _______________________________________________________
|             |                                                       |
|  _   _  ___,| K. Anton Feenstra                                     |
| / \ / \'| | | Dept. of Pharmacochem. - Vrije Universiteit Amsterdam |
|(   |   )| | | De Boelelaan 1083 - 1081 HV Amsterdam - Netherlands   |
| \_/ \_/ | | | Tel: +31 20 59 87608 - Fax: +31 20 59 87610           |
|             | Feenstra at few.vu.nl - www.few.vu.nl/~feenstra/         |
|             | "If You See Me Getting High, Knock Me Down" (RHCP)    |
|_____________|_______________________________________________________|
_______________________________________________
gmx-developers mailing list
gmx-developers at gromacs.org
http://www.gromacs.org/mailman/listinfo/gmx-developers
Please don't post (un)subscribe requests to the list. Use the 
www interface or send it to gmx-developers-request at gromacs.org.




More information about the gromacs.org_gmx-developers mailing list