[gmx-users] Continuing a FEP alchemical

Alex alexanderwien2k at gmail.com
Wed Dec 28 16:41:32 CET 2016


Hello Gromacs user,

I have a free energy simulation converged results harvested  by alchemcial
analysis in 15 lambada windows, now, I would like to increase the number of
lambada windows to 20. Would you please let me know how I can continue my
old simulation with 15 windows to 20 windows?

Regards,
Alex


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