[gmx-users] dg/dl unit
nextgame at hotmail.com
Thu Nov 3 00:06:38 CET 2005
I am just wondering what the units for dg/dl mean in a free energy
perturbation run. I get a graph of dG/dl (KJmol-1nm-2l-1) vs time (ps). Now,
ideally i want KJmol-1lambda-1 vs lambda graph so that i can integrate it to
get back a value that is KJ/mol.
I am just wondering what (nm-2l-1) unit means and if it is related to ps as
thank you very much in advance.
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