[gmx-users] Re: g_velacc

Ishwor ishwor.poudyal19 at gmail.com
Fri Jul 5 10:50:09 CEST 2013


I have taken the fit for 2ns in Einsteins curve to calculate the diffusion
coefficient but when i take the values up to 100 ps for velocity auto
correlation i get the matching result...Is it good to do such thing? i will
be happy if you guide me.
I have attached the graph of VAC herewith.
Thanks <http://gromacs.5086.x6.nabble.com/file/n5009582/vac.jpeg> 



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