[gmx-users] Optimum slice size (-sl)
Ashutosh Akshay Shah
ashah at aggies.ncat.edu
Sat Feb 13 14:57:47 CET 2016
Hello GROMACS users,
What is the optimum slice size when trying to capture as much variation as
possible?
Consider a box with an electrolyte having anions and cations distributed in
it.
*Would be accurate to specify a slice size smaller than the diameter of the
ions while calculating the charge variation across the box?*
Thanks!
Ashutosh Shah
Joint School of Nanoscience and Nanoengineering
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