VMD-L Mailing List
From: Sibel Cakan (sibelc_at_stu.khas.edu.tr)
Date: Mon Jan 03 2011 - 04:15:23 CST
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Dear all
I’m trying to run a residue-based CG MD simulation with NAMD for a system which includes waters, proteins, and a lipid bilayer.During the MD simulation I had several problems and I had checked this page http://www.ks.uiuc.edu/Research/namd/wiki/index.cgi?NamdTroubleshooting and the mailing list which reccomends to do heating protocol.So I tried the heating protocol and assign the temperature from 30 to 323 K.But in the log file the temperature could not reach the 323K(the temperature was ~270-280) and the simulation gives error that 'Atoms moving too fast' .
Could somebody help me out? Thanks a lot.
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