[AMBER] Using Distance Restraints in TMD

From: Aravind R <aradrive1.gmail.com>
Date: Mon, 14 Jan 2019 20:10:13 +0530

Dear Amber Users/Authors,
  I am performing TMD on a system, trying to simulate from open to close
conformer. During this simulation I would like to hold a salt bridge with a
distance restraint. And the salt bridge lies in a region on which TMD
restraints are applied.
Is it possible/okay (both technically and logically) to combine Cartesian
positional restraints and TGTMD restraints in the same simulation.
Best regards and many thanks in advance,
Aravind R
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Received on Mon Jan 14 2019 - 07:00:02 PST
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