Hi Amber users,
I tried to run sander (serial and parallel version) in AMBER 9.0 with
the input which works fine in AMBER 7.0
I got the error message for both sanders of serial and parallel version.
"The READ statement on the file fort.9 cannot be completed because the
end of the file was reached. The program will stop."
What is this about? How can I solve this?
The installation of AMBER 9.0 is fine for both sanders.
Well, does the input have something wrong?
Can't I use the input which is generated from AMBER 7.0 in AMBER 9.0?
My input is the following:
------------------------------------------------------------------------
----------------------
Dynamic Simulation with Constant Temperature
# Control section
&cntrl
ntwe=2000, ntwx=2000, ntwv=0, ntpr=2000,
ntt=1, temp0=300.0, tempi=5.0, tautp=1.0,
ntb=0, ntc=2, ntf=2, cut=9999.0,
nstlim=250000, dt=0.0020,
ntp=0,
ntx=1, nmropt=1
/
&wt
type='TEMP0', istep1=1, istep2=50000, value1=5.0, value2=300.0,
/
&wt
type='TEMP0', istep1=50001, istep2=200000, value1=300.0, value2=300.0,
/
&wt
type='END'
&end
LISTOUT=POUT
DISANG = restraints_2.in
------------------------------------------------------------------------
---------------------
Thanks
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Received on Wed May 24 2006 - 06:07:16 PDT
