(0)18 471 4539
> erik.markl...@kemi.uu.se<mailto:erik.markl...@kemi.uu.se>
>
> On 13 Sep 2017, at 06:16, Abhinav Srivastava (P14CHM002) <
> srivastav...@iitj.ac.in<mailto:srivastav...@iitj.ac.in>> wrote:
>
> Dear Gromacs Users,
>
> Kindly consider this as my quer
Dear Gromacs Users,
Kindly consider this as my query mail as in the last mail, subject line was
not complete. I apologize for the same .
I am trying to calculate hydrogen bond correlation function Cdd(t) for bulk
water (TIP4P/2005 water) using reversible geminate recombination as
mentioned in
Dear Gromacs Users,
I am trying to calculate hydrogen bond correlation function Cdd(t) for bulk
water (TIP4P/2005 water) using reversible geminate recombination as
mentioned in
Markovitch et al., J. Chem. Phys.,129,084505(2008).
Following is the command which I have used :
g_hbond -f NVT.xtc -s
Dear Gromacs developers,
Following is my email address for posting queries to GROMACS
srivastav...@iitj.ac.in
Best regards,
*Abhinav Srivastava*
*Research Scholar*
Indian Institute of Technology, Jodhpur
Rajasthan
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