Hi all,
I was curious if current pmemd code (cuda) of Amber-14 or Amber-16
have all the support to do PMF calculation shown in AMBER Advanced
Tutorial 17 (Umbrella Sampling Example Calculating the PMF for
Alanine Dipeptide Phi/Psi Rotation).
Best,
Mish
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Received on Fri May 27 2016 - 08:00:02 PDT
