Hi AMBER Users,
I am trying to learn AMBER via following AMBER tutorials. During MD simulation's step of heating, I got this error message,
$AMBERHOME/bin/sander -O -i 02_Heat.in -o 02_Heat.out -p parm7 -c 01_Min.restrt -r 02_Heat.restrt -inf 02_
Heat.mdinfo
At line 719 of file /opt/amber22_src/AmberTools/src/sander/nmrcal.F90 (unit = 5, file = '02_Heat.in')
Fortran runtime error: End of file
Error termination. Backtrace:
#0 0x7f75a3943960 in ???
#1 0x7f75a39444d9 in ???
#2 0x7f75a3b9817b in ???
#3 0x7f75a3b993c4 in ???
#4 0x7f75a3b9be41 in ???
#5 0x7f75a3b9c0e3 in ???
#6 0x7f76051b9514 in restal_
#7 0x7f76051bc506 in master.0.nmrcal_
#8 0x7f76051bbe04 in restlx_
#9 0x7f76051df9b6 in mdread1_
#10 0x7f76051a8f36 in sander_
#11 0x7f76051a7f1f in MAIN__
#12 0x7f76051a7f84 in main
I tried many ways, but to no avail. Any help in this regard will be greatly appreciated.
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Received on Fri Dec 01 2023 - 23:00:02 PST
