[gmx-users] degree of freedom

[Nicolas SAPAY]

Actually, I had a doubt on what happens when movements of the center of
mass are removed and when the position of a molecule is constraint... Just
wanted to check my calculations...

Nicolas

<quote who="Mark Abraham">
> Nicolas SAPAY wrote:
>> Hello everybody,
>>
>> I want to know the number of degrees of freedom in my system... Is there
>> a
>> way to calculate that with Gromacs?
>
> 3N-5 for each molecule?
>
> Mark
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-- 
[ Nicolas Sapay Ph.D. ]
University of Calgary, Dept. of Biological Sciences
2500 University Dr. NW, Calgary AB, T2N 1N4, Canada
Tel: (403) 220-6869
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