[gmx-users] time step size and non bond constraint

Mark Abraham Mark.Abraham at anu.edu.au
Wed Apr 18 12:09:26 CEST 2007


kanin wichapong wrote:
> Dear All,
>         In my MD system, I applied a time step just 1 fs and I didn't 
> apply bond constraints.  I would like to know that is there will be any 
> problems with this parameter. Can I used this parameter for my MD 
> simulations?

Probably fine - see what other people have done with the sort of system 
you are simulating.

Mark



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