AMBER Archive (2005)

Subject: AMBER: amber8 in IBM-SP4

From: Jiten (jiten_at_postech.ac.kr)
Date: Mon Jan 31 2005 - 21:32:28 CST


Hello amber users,

When running sander parallel job in IBM64-RS6000, I get the following error sometimes. but not always. Could someone suggest on how to fix this problem.

***** Processor 0
***** System must be very inhomogeneous.
***** Readjusting recip sizes.
 In this slab, Atoms found: 12498 Allocated: 12492

Thanking you,

N. Jiten Singh
C/O Prof. Kwang S. Kim
Department of Chemistry
Pohang University of Science and Technology
San 31, Hyojadong, Namgu
Pohang 790-784, Korea
Phone : 82-54-279-5853 ( Lab ) / 279-4138 ( Appt )
Fax : 82-54-279-8137 (or +82-54-279-3399)
Web : http://csm.postech.ac.kr/ and http://www.postech.ac.kr/e
Home Page : http://www.geocities.com/njs_19

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