AMBER Archive (2008)Subject: AMBER: NMA
From: Steve Seibold (seibold_at_chemistry.msu.edu)
Date: Fri Jul 11 2008 - 11:34:00 CDT
Hello amber
I am just trying to run the tutorial "Crown Ether" (using amber8) and when I load the input file I get the following error
"PGFIO-F-228/namelist read/unit=5/end of file reached without finding group.
File name = nmode_min.in formatted, sequential access record = 17
In source file _rdinp.f, at line number 112"
My input file is:
&data
ntrun=4,
nsave=2,
ndiag=2,
cut=95,
nprint=100,
drms=0.00001,
maxcyc=100,
bdwnhl=0.01,
dfpred=0.1,
scnb=2.0,
scee=2.0,
nvect=200,
ntxo=0,
%end
I don't know what "finding group" means. I am not sure what group it is looking for. I do have all the other requisite files such as crown_plain.crd and crown_plain.top.
Can someone help me please.
Steve
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