[AMBER] Updates for PBSA energy calculations

From: Christina Berti <cberti.purdue.edu>
Date: Mon, 28 Sep 2015 19:17:04 -0400 (EDT)

Hello,

To my knowledge, neither sander.MPI nor pmemd.MPI are implementable when performing PBSA energy calculations in sander. I was wondering if users should expect an update in the near future. Thank you.

Christina

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Received on Mon Sep 28 2015 - 16:30:04 PDT