[gmx-users] Regarding Extension of the potential lookup tables

Mark Abraham Mark.Abraham at anu.edu.au
Fri Nov 4 15:31:27 CET 2011

On 4/11/2011 10:41 PM, Ravi Kumar Venkatraman wrote:
> *Dear All,
>              Could anybody tell me what is the purpose of Extension of 
> the potential lookup tables beyond the cut-off.*

Check out manual 7.3.12

> *I have read somewhere that the sum the smallest diagnol of the box 
> and rlist should be equal to table-extension. Please explain me the same.*

I doubt that you read that.


> *With Regards,
> Ravi Kumar Venkatraman,
> IPC Dept., IISc,
> Bangalore, INDIA.
> +91-9686933963.*

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