[gmx-users] how is dVpot/dlambda calculated

Dennis Sprous, PhD dsprous at bioleap.com
Fri Jul 1 20:16:29 CEST 2011

Could someone forward the citation of how dVpot/dlambda is calculated 
for a free energy run.

I am specifically interested in knowing if it is an analytic or numeric 
based calculation.

any problem        worth attack
proves its worth   by fighting back

Dennis Sprous, PhD
BioLeap Inc.
Cambridge MA 02141

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