[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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