[gmx-users] Residual Fraction with respect to coordinate

Steven Neumann s.neumann08 at gmail.com
Mon Jan 30 19:30:35 CET 2012


Dear Gmx Users,

I run the simulation of my protein attached to a surface. I want to plot
the dependence of my protein residues (charged, polar, nonpolar) fraction
(volume or mass) with respect to the coordinate - the distance from the
surface (specific point or a line of points). Will you suggest command in
Gromacs?

Thank you,

Steven
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