[phenixbb] ensemble refinement crash.

Rajendra Sharma rajenbiotech at gmail.com
Tue Nov 22 03:26:28 PST 2016


Dear all,

I am running  ensemble refinement using phenix-1.10. The calculations are
running good until the Ensemble reducer where the jobs get killed  in some
cases automatically without giving output pdb. I am using default setting
to run the jobs.

pdb_stored_per_block is 50 totaling 500 towards the end. Is the crash
happening because of memory? Will reducing the number of pdb per block help?

Secondly, how can I restart the killed runs?

thanks in advance.

Raji



*Rajendra SharmaResearch Scholar, PhD.*
*Centro Nacional de Biotecnología <http://www.cnb.csic.es/>,*

*Universidad Autónoma de Madrid,*

*Madrid, Spain.Mobile No. +31-656688390*
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