AMBER Archive (2004)

Subject: AMBER: partition error in shake

From: Guanglei Cui (cuigl_at_csb.sunysb.edu)
Date: Fri Apr 23 2004 - 10:18:19 CDT

Dear all,

After I managed to get SCALI to work with AMBER8, I found I can't use
more than 4 CPUs for one of my systems (80,000 atoms), but it worked
fine with a regular DNA test case (10 base pairs). It failed because of
"partition error in shake". Before I dive into shake.f, I wonder if
anyone has a quick guess what might be the problem. Thanks in advance.

Regards,

Guanglei
-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber_at_scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo_at_scripps.edu