VMD-L Mailing List
From: Jevgenij Raskatov (jraskato_at_ucsc.edu)
Date: Fri Mar 06 2015 - 14:01:48 CST
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Dear all,
I just ran a Maxwell-Boltzmann energy distribution following the script
that is provided with the NAMD tutorial, and the average temperature I am
getting is far too low, and not at all the 310K I had specified. The script
does work just fine on the tutorial example (Ubiquitin). Any idea at what
step I might be making an error?
Thanks
-- Dr. Jevgenij A. Raskatov Assistant Professor in Chemistry and Biochemistry Tel.: +1-831-459-2978 Department of Chemistry and Biochemistry Physical Science Building 356 1156 High Street Santa Cruz, CA 95064 USA
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