[gmx-users] g-WHAM

[Carsten Kutzner]

Hi Mohsen, 

for a start, it is always a good idea to read the help
text of a command you are interested in, or to check
the most recent version of the manual. Using Gromacs 4.5

g_wham -h 

will guide you to a JCTC paper about g_wham, which
is a nice starting point. Check out this paper as well
as the references therein!

Also Google is your friend here:
http://pubs.acs.org/doi/abs/10.1021/ct100494z
http://onlinelibrary.wiley.com/doi/10.1002/jcc.540130812/pdf

Carsten


On Dec 14, 2010, at 9:20 AM, mohsen ramezanpour wrote:

> Dear All 
> 
> What is the algorithm of g-WHAM?
> in the other words ,what is the weighted histogeram analysis method?
> Thanks in advance for your reply
> Mohsen
> 
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--
Dr. Carsten Kutzner
Max Planck Institute for Biophysical Chemistry
Theoretical and Computational Biophysics
Am Fassberg 11, 37077 Goettingen, Germany
Tel. +49-551-2012313, Fax: +49-551-2012302
http://www.mpibpc.mpg.de/home/grubmueller/ihp/ckutzne