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AMBER Archive (2002)Subject: NTX / IREST inconsistency
From: Bimo Ario Tejo (bimo7_at_linuxmail.org)
Dear Amber users,
I got a problem when I restarted the simulation using 500 ps simulated coordinate (Amber7). I need ONLY the coordinates and box size from restart file (.xyz), because I introduce new random number generator seed for subsequent simulation.
Here is the input file:
# unconstrained simulation with constant pressure
BUT I got this error message in output file:
NTX / IREST inconsistency
*** input error(s)
Some of my friends tried the same process using Amber 6 and it works. What does *inconsistency* mean? Can I use ntx=1 and irest=1? I don't need velocity from restart file, so I just use ntx=1.
Thank you for help me.
-bimo-
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