From: Josef Scheiber (Josef.Scheiber_at_mail.uni-wuerzburg.de)
Date: Fri May 14 2004 - 03:59:24 CDT
I want to use GROMACS topology files generated by PRODRG (http://davapc1.bioch.
dundee.ac.uk/programs/prodrg/prodrg.html) in some calculations. Following the
user's guide everything seems to be working fine, but when all parameters are
read in, NAMD quits with this message:
> Warning: unknown mode pairs
> Must have 7 args for funct=1,2
> ----------------- Processor 0 exiting: Called CmiAbort -------------------
> Reason: unexpected call to exit by user program. Must use CkExit, not exit!
> Charmm++ fatal error:
> unexpected call to exit by user program. Must use CkExit, not exit!
> abnormal program termination
Searching the mailing list (btw: the search engine is a great idea!)
unfortunately didn't provide any helpful information. Does anybody have a hint,
how to proceed from this point?
Thanks in advance,
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