Hi all,
When trying to make sander (Amber8) writing mden and mdcrd as
unformatted/binary files (using IOUTFM=1 switch), I got the following
error message:
PGFIO-F-215/formatted write/unit=15/formatted/unformatted file conflict.
File name = mden unformatted, sequential access record = 1
In source file _dynlib.f, at line number 1328
That means, mden file is opened as unformatted (I have used the switch
IOUTFM=1), however, in subroutine mdeng (dynlib.f) sander tries to
write using formatting.
Can anybody help how to fix it?
Best,
Martin Mucha
-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber.scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo.scripps.edu
Received on Tue May 25 2004 - 09:53:01 PDT