i am a new user to amber.
i constructed polyala using xleap,then i minimised the system using
sander program.
when i am trying to do dynamics i got the following error.pls help me
in this regaurd.
formatted I/O: end of file -1
apparent state: unit 9 named polyala.rst1
last format: (6F12.7)
Unit 9 is a sequential formatted external file
*** Execution Terminated (-1) ***
i gave the following inputs for dynamics
&cntrl
imin =0,
IREST = 1,
NTX = 7,
NTT = 1,
TEMP0 = 300.0,
TAUTP = 0.2,
ntp = 1,
taup = 0.2,
ntb = 2,
ntc=4,
ntf=2,
NSTLIM = 100,
ntwe = 2,
ntwx = 2,
ntpr =5,
&end
END
--
S.Sundar Raman
Chemical Lab,
CLRI
Chennai-20
ph: 044-24411830
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Received on Tue Feb 08 2005 - 11:53:00 PST
