Re: [AMBER] About the source file regarding SMD calculations

From: Mo Chen <mc842.cornell.edu>
Date: Tue, 28 Feb 2012 21:38:10 -0500

Aron,
Thank you very much!

Mo

Sent from my iPod

On Feb 28, 2012, at 9:32 PM, Aron Broom <broomsday.gmail.com> wrote:

> you might be looking for something along the lines of ncsu_smd.* in the
> sander /src.
>
> On Tue, Feb 28, 2012 at 6:08 PM, Mo Chen <mc842.cornell.edu> wrote:
>
>> Dear Amber developers,
>> May I ask what is the name of the source file that defines the steered
>> potential or force in SMD simulation and describes how work is calculated?
>> Many thanks!
>>
>> Best,
>> Mo
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>>
>
>
>
> --
> Aron Broom M.Sc
> PhD Student
> Department of Chemistry
> University of Waterloo
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Received on Tue Feb 28 2012 - 19:00:02 PST
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