Dear All,
Is there a way to extract the pull force (and not the total force or energy)
for a specified group (indexed) or center of mass, rather than just the total
pullf over a run? I wanted to break up the pullf into varied sub
contributions, however as it is applied to the center of mass o
Dear All,
I woundered if anyone has scripts/tools or suggestions for analyzing energy
changes from extracted run data. Mostly I end up with 20 spread sheet columns
for a large system with 2x2 domain proteins, a peptide of 10-20 amino acids and
soome small molecules. I've been playing with th
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