In what are the initial structures different?
Dear All:
I have a question about the differences of the initial structure built for homology modeling. Can anyone tell me how exactly are these initial structures different? Do they differ in the secondary structures in uncertain regions? I cannot find this information in the manual.
For example, by using
a = automodel() a.starting_model = 1 a.ending_model = 50
I can built 50 different homology models starting from different initial structures, but I have want to know how these different initial structures are constructed.
Thanks very much for help.
Best, Bin
On 04/08/2012 11:58 PM, BIN ZHANG wrote: > I have a question about the differences of the initial structure built > for homology modeling. Can anyone tell me how exactly are these initial > structures different? Do they differ in the secondary structures in > uncertain regions? I cannot find this information in the manual.
See http://salilab.org/modeller/9.10/manual/node470.html, in particular step 3 and substep 3. The initial structures are simply randomized by calling selection.randomize_xyz().
Ben Webb, Modeller Caretaker
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BIN ZHANG
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Modeller Caretaker