[gmx-users] Distance calculation

rose rahmani rose.rhmn93 at gmail.com
Mon Nov 26 01:11:20 CET 2018


My system contains 20 amino acids around nanotube. I want to know the
adsorption amount of AA during simulation time; the adsorption occurs when
the distance between one of non-hydrogen atoms of AA and the tube surface
was less than 0.5 nm. So how can i calculate this property?

Would you please help me?

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