Dear AMBER users and developers,
My goal is to obtain additional information regarding the PME calculation
in my NVT simulations. I have been trying to change my verbosity setting
with the 'verbose' keyword in my MD-input file. Unfortunately, regardless
of the value that I set (e.g. 1 or 2), my output file does not contain
additional information as opposed to when verbose = 1. Am I missing
something in my input file? Or is this something that I am not able to do?
The software version that I have been using for these simulations is
AMBER14 and my input script is pasted below.
&cntrl
iwrap = 1,
imin =0,
irest = 1,
ntx = 5,
nstlim = 1000000,
dt = 0.0010,
ntwx = 1000,
ntpr = 1000,
ntwv = 1000,
ntb = 1,
cut = 10,
ntt = 3,
gamma_ln = 2.0,
temp0 = 298.,
ig = -1,
/
&ewald
verbose = 2,
/
&end
Thank you for you consideration and time.
Sincerely,
*An T. Ta *
Department of Chemistry | Ph.D. Candidate
Coolbaugh Hall | Room 118
Golden, CO 80401
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Received on Wed Oct 07 2020 - 12:00:02 PDT
