From: Shane.OMahony (Shane.OMahony_at_ul.ie)
Date: Fri Jul 18 2014 - 11:18:05 CDT
I was wondering if it's possible to calculate the force needed to keep a protein a fixed distance from a surface using NAMD? I want to constrain the center of mass of the protein and then calculate the PMF using an unbiased potential.
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