From: Anna Borlsky (annanamd_at_gmail.com)
Date: Fri Jan 10 2014 - 15:27:34 CST
I am using periodic boundary conditions. In this situation is it important
to use langevinPiston on and langevin temperature control on? And what
about rigid bonds?
I am using timestep 1.0 so should I use rigid bonds for water or none?
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