AMBER Archive (2007)

Subject: AMBER: Ewald BOMB....... what is this..

From: Vijay Manickam Achari (vjrajamany_at_yahoo.com)
Date: Wed Apr 18 2007 - 22:13:38 CDT

Dear great users

During simulation run, the program terminates by
itself by saying 'Ewald Bomb'.

The message is as below:

* NB pairs 160 259074 exceeds capacity (
     259200) 15
     SIZE OF NONBOND LIST = 259200
 EWALD BOMB in subroutine ewald_list
 Non bond list overflow!
 check MAXPR in locmem.f
[15] MPI Abort by user Aborting program !
[15] Aborting program!
p15_14666: p4_error: : 1

**********************************

What this means and how to overcome this problem??

Thanks in advance.
Vijay

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