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From: leila karami (karami.leila1_at_gmail.com)
Date: Thu Mar 10 2011 - 08:04:14 CST
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Thanks Dear Dr.Olaf
Your means is that after loading .xyz file or HISTORY file (has box vector)
I select àextension àTK Concol, then i write pbc set {{3.460 0.000 0.000}
{1.730 2.997 0.000} {0.000 0.000 10.00}}
-namd -all
I did these process but I got this error” invalid command name “pbc”
Would you please explain more clearly?
Thanks in advance
-- Leila Karami Ph.D. student of Physical Chemistry K.N. Toosi University of Technology Theoretical Physical Chemistry Group
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