[gmx-users] convert B-factor
AntonioLeung
royaltramp at live.cn
Mon Dec 28 07:52:27 CET 2009
I know how to calculate, and have calculated the RMSF of two trajectories (of the same molecule), and I want to compare the two RMSFs. I want convert their discrepancy into B-factors. Can you tell me more detailed?
------------------ Original ------------------
From: "Mark Abraham"<Mark.Abraham at anu.edu.au>;
Date: Mon, Dec 28, 2009 11:04 AM
To: "Discussion list for GROMACS users"<gmx-users at gromacs.org>;
Subject: Re: [gmx-users] convert B-factor
AntonioLeung wrote:
> Dear all,
> I want to convert the difference of two rmsf data sets into B-factor of
> a coordinate (to illustrate their difference by coloring the structure
> by B-factor), can anyone tell me how to do it?
g_rmsf -h
Mark
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