From: Khoualdi Asma Feriel (asma.feriel.khoualdi_at_umontreal.ca)
Date: Thu Apr 09 2020 - 21:32:20 CDT
Hello,
Simple question: I used CHARMMGUI NAMD input equilibration files and used NAMD2 to get output and log files, yet I don't get .coor .vel and .xsc of equilibration step 6.1 so step 6.2 gives me fatal error that its unable to open extended file system.
I reduced numsteps and run steps but the issue persists. It now also says
Reason: FATAL ERROR: too many args
while executing
"run 50000 #50 ps"
(file "step6.1_equilibration.inp" line 171)
Charm++ fatal error:
FATAL ERROR: too many args
while executing
"run 50000 #50 ps"
(file "step6.1_equilibration.inp" line 171)
Abort (core dumped)
------------- Processor 0 Exiting: Called CmiAbort ------------
Reason: FATAL ERROR: Unable to open extended system file.
Please help me out, been stuck for days and I haven't received a reply earlier.
Thank you.
Best,
Asma
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