Dear Amber users,
I'm running free energy calculations in Sander (TI), my system is fully optimized.
But I have the error in the middle of run:
EWALD BOMB in subroutine ewald_list
volume of ucell too big, too many subcells
list grid memory needs to be reallocated, restart sander
How could I fix this problem?
Thank you in advance
Dr. E. Nikitina
-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber.scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo.scripps.edu
Received on Tue Jul 22 2003 - 17:53:01 PDT
