[gmx-users] visualize normal mode

Anton Feenstra feenstra at few.vu.nl
Thu Jun 16 12:29:06 CEST 2005


Lianqing Zheng wrote:

> Dear gmx-pals,
> 
> I'm wondering if there is any visualization tool to watch the movement of
> each vibrational mode after I get the frequencies and eigenvectors from
> gmx, just like Molden visualizes Gaussian's freq calculations.

g_anaeig lets jou project coordinates along the eigenvectors in to a 
(series of) pdb file(s). These you can view as a trajectory (with e.g. 
VMD or ngmx), or superposed (with e.g. rasmol).

-- 
Groetjes,

Anton

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

  _____________ _______________________________________________________
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|  _   _  ___,| K. Anton Feenstra                                     |
| / \ / \'| | | Dept. of Pharmacochem. - Vrije Universiteit Amsterdam |
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