Re: [AMBER] help in analysis

From: Paul Mortenson <Paul.Mortenson.astx.com>
Date: Wed, 21 Jan 2015 13:34:41 +0000

Shouldn't that be 0.05ps/frame? Or have I not had enough coffee yet....

-----Original Message-----
From: Jason Swails [mailto:jason.swails.gmail.com]
Sent: 21 January 2015 12:13
To: amber.ambermd.org
Subject: Re: [AMBER] help in analysis

On Wed, 2015-01-21 at 16:08 +0530, Robin Jain wrote:
> Dear user,
> i am in confusion that if i run a program for 3000ps and i got 60000
> frames the what will be the time per frame for diffusion calculation.

time per frame is time/frame. 3000ps/60000frames = 0.5ps/frame.

--
Jason M. Swails
BioMaPS,
Rutgers University
Postdoctoral Researcher
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Received on Wed Jan 21 2015 - 06:00:04 PST