AMBER Archive (2007)

Subject: AMBER: solvate shell

From: janavi raghavan (genie1080_at_yahoo.co.in)
Date: Thu Mar 15 2007 - 10:33:13 CST

 I am trying to solvate a protein with one layer of
water.does the solvate shell command in amber perform
the above operation .does solvateshell need the use of
non-periodic boundary condition?if so then how do i
include a code in the input file to restrain the
surface water molecules only so that it does not
evaporate.
    
   Thank you in advance
   janavi raghavan

                
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