[AMBER] Calculating displacement from PMF

From: Pinky Mazumder <pmazumder67.gmail.com>
Date: Tue, 30 Mar 2021 12:10:08 -0500

Hi AMBER users,

I am performing simulations using umbrella sampling smd.

How can I get the value of displacement from PMF?

Another query, what is the difference between smd and umbrella sampling?

Thank you.

Sincerely,
Pinky
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Received on Tue Mar 30 2021 - 10:30:02 PDT