Hello Rakesh,
The water-water energies reported in GIST are indeed corrected to avoid
double counting. The 'unreferenced' refers to the energies being determined
directly from the sampled frames and not compared to some reference
quantity (such as bulk).
Hope this helps,
--Steve
On Tue, Aug 29, 2017 at 7:56 AM, Rakesh Srivastava <allahabad.21.gmail.com>
wrote:
> Hello everyone,
>
> Please let me know that, the unreferenced water-water interaction potential
> we get in GIST output, has been corrected for double counting or not ?
>
> Thanks in advance.
>
> Rakesh Srivastava
> Research Fellow
> School of Computational & Integrative Sciences
> Jawaharlal Nehru University, New Delhi-110067
> India
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Received on Tue Aug 29 2017 - 07:30:03 PDT
