[AMBER] WaterBox is getting distorted while running PMF

From: Airy Sanjeev <airy.sanjeev01.gmail.com>
Date: Fri, 16 Aug 2019 09:47:45 +0530

Hello Amber User,
I am doing potential of mean force calculation for dimer structure using
umbrella sampling method. While running the production run, the waterbox is
getting distorted. I have used iwrap command but even then the waterbox is
not properly oriented. Kindly help in this regard.

Thanking you in advance 


-- 
with best regards,
*Airy Sanjeev, PhDPost Doctoral Fellow*
*Indian Institute of Technology Guwahati, Guwahati*
*Assam-781039, India*
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Received on Thu Aug 15 2019 - 21:30:02 PDT
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