Dear Dr. Schwieters, Following your advice I am making transition from XPLOR language to python interface of XPLOR to be able to run python scripts for my structure calculation.
I am going through Xplor-nih-tutorial-2009 by following instructions in each tutorial file in each folder. When I run in *gb1_simple* folder command %xplor -smp 2 -py -o anneal_nordc.out anneal_nordc.py I get the following message in the shell where I am running this command: process 0: irregular exit. process 1: irregular exit. Do you think this is normal or I am doing smth wrong? I am going to run the similar script for my structure calculation, so I worry that I may do smth wrong and may not notice. So running tutorial scripts is like a test of performance for me. Thank you for all the help you have given to me so far! -- Best regards, Anna Kuznetsova -------------- next part -------------- An HTML attachment was scrubbed... URL: http://dcb.cit.nih.gov/pipermail/xplor-nih/attachments/20110520/c90e978b/attachment.html
