14 February 2014 1 253 Report

I have done SMD of telomeric quadruplex DNA using NAMD software, GBIS implicit solvent model and CHARMM-27 ff. I have pulled the center of mass of the 1st base keeping center of mass of the last base fixed. I am very confused about the direction of pulling. I am attaching here the tcl script (which specifies force direction) I have used.

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