Dear AMBER user
I am running my protein sample for MD simulation (solvent effect) for 10 ns (on SGI altix UV 10) . Was able to complete sucessfully heating stage. While running the producition stage, the program was able to complete only the first stage (500 ps) and thereafter it was not able to progress. The error showed is as follows:
------------------------------------------------------------------------------------------------------------------------------------------------------------------------ramesh.sgiUV:~> ./PROD.sh
forrtl: severe (64): input conversion error, unit 9, file /home/ramesh/equil1.rst
Image PC Routine Line Source
sander 0000000000C0BF9D Unknown Unknown Unknown
sander 0000000000C0AAA5 Unknown Unknown Unknown
sander 0000000000BA3D49 Unknown Unknown Unknown
sander 0000000000B3D30A Unknown Unknown Unknown
sander 0000000000B3CB00 Unknown Unknown Unknown
sander 0000000000B676DB Unknown Unknown Unknown
sander 00000000004E9835 Unknown Unknown Unknown
sander 00000000004ABDED Unknown Unknown Unknown
sander 00000000004AA85C Unknown Unknown Unknown
sander 00000000004051CC Unknown Unknown Unknown
libc.so.6 00002B249A274BC6 Unknown Unknown Unknown
sander 00000000004050C9 Unknown Unknown Unknown
gzip: equil2.mdcrd: No such file or directory
Unit 30 Error on OPEN: equil2.rst
gzip: equil3.mdcrd: No such file or directory
Unit 30 Error on OPEN: equil3.rst
........
........
Unit 30 Error on OPEN: equil19.rst
gzip: equil20.mdcrd: No such file or directory
DONE
------------------------------------------------------------------------------------------------------------------------------
To me it appears some thing wrong in equil1.rst file, which I am not able to figure it out. I am attaching the equil1.rst file I used for simulation
request you to kindly suggest solution to my problem
Thanking you
Ramesh K V
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Received on Wed Nov 30 2011 - 20:00:02 PST
