From: ARTURAS ZIEMYS (ziemys.1_at_osu.edu)
Date: Mon Feb 27 2006 - 11:59:15 CST
Can anybody point to how gradually change (increase/decrease) pressure ?
I tryed by adding the lines at the end of my configuration file:
At the second step when pressure is increased NAMD writes errors to encrease margins or disable useFlexibleCell.
Doing my way, should I include minimizations before each step ? Or do something another way ?
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