CYANA Command: atoms swap: Difference between revisions
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== Parameters == | == Parameters == | ||
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== Description == | == Description == | ||
Swap diastereotopic partners in peaks, distance restraints, coupling constants and chemical shifts (but not in the structure itself) for the selected atoms. By default, the selection made in the most recent [[CYANA Commands: atoms select|'''atoms select''']] command is used, or all atoms if no selection has been made so far. It is sufficient to select one atom of a diastereotopic pair to swap both diastereotopic partners. Residual dipolar couplings and pseudocontact shifts are not modified. | |||
restraints, coupling constants and chemical shifts (but not in the | |||
structure itself) for the atoms | |||
default, the selection made in the most recent '''atoms select''' command | |||
is used, or all atoms if no selection has been made so far. It is | |||
sufficient to select one atom of a diastereotopic pair to swap both | |||
diastereotopic partners. | |||
Revision as of 14:57, 6 August 2009
Parameters
- selection=string
- (default: none)
Description
Swap diastereotopic partners in peaks, distance restraints, coupling constants and chemical shifts (but not in the structure itself) for the selected atoms. By default, the selection made in the most recent atoms select command is used, or all atoms if no selection has been made so far. It is sufficient to select one atom of a diastereotopic pair to swap both diastereotopic partners. Residual dipolar couplings and pseudocontact shifts are not modified.