Dear all,
In my simulations I am using 'ntt=3'.
I noticed that the ig value is better to be set to '-1'.
I forgot to do this and now I have a set of restarted simulations in which
ig parameter is not set. Although in the manual it says that the default
value for this parameter is '-1', but when I look in the mdout files of
different restart runs, all of them have the exact same ig value (71277)
(actually ig has this value in any simulation which I have done so far with
amber!).
My question is that: if the default value is -1 in the case where I have
not defined this parameter explicitly, why all the mdouts have the same ig?
and should I rerun my simulations with 'ig=-1'?
Thanks a lot for your help and concern.
Best regards,
Azade
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Received on Mon Feb 13 2017 - 08:30:03 PST
