[gmx-users] Calculating diffusion coefficient in three dimension

Venkat Reddy venkat4bt at gmail.com
Tue Nov 12 06:01:00 CET 2013


Dear all,
I am simulating a spherical lipid vesicle. I want to calculate the
diffusion coefficient for each lipid component in 3D. How to calculate it
using g_msd (or any other tool like g_velacc)?

Thank you for your concern

-- 
With Best Wishes
Venkat Reddy Chirasani



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