AMBER Archive (2003)

Subject: Re: AMBER: constant energy simulation

From: Lishan Yao (yaolisha_at_pilot.msu.edu)
Date: Wed Aug 13 2003 - 08:00:20 CDT

I removed the rotational motion before I do the frequency analysis.

Lishan

On Tue, 2003-08-12 at 18:39, Xavier Periole wrote:
> There is probably an option in AMBER to remove the motion/rotation of the
> molecule ! This is often used in MD simulations.
>
> XAvier
>
>
>
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-- 
Lishan Yao <yaolisha_at_pilot.msu.edu>
MSU

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