Grid fragment: Difference between revisions

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= grid fragment =
= grid_fragment =
        
        
== Parameters ==
== Parameters ==

Latest revision as of 19:18, 28 January 2009

grid_fragment

Parameters

selection=string
(default: none)
none

Description

Defines a fragment to be analyzed by a subsequent grid search. The angle selection must select a connected subset of the dihedral angles. Alternatively, the option none can be given to undefine the current fragment. For instance,

 grid fragment "PSI 7 + PHI PSI CHI1 8 + PHI 9"

defines a molecular fragment comprising the PSI angle of residue 7, the PHI, PSI and CHI1 angle of residue 8, and the PHI angle of residue 9.