Recipe: Unfreeze

created by StackOverflow

Profile

• Name: Unfreeze
• ID: 48714
• Shared with: Public
• Parent: None
• Children: None
• Created on: March 28, 2014 at 06:39 AM UTC
• Updated on: March 28, 2014 at 06:39 AM UTC
• Description:

  Unfreeze sidechains of manually unfrozen structures after a freeze all

Code

--unfreeze sidechains. 
-- this allows you to freeze all, then manually unfreeze a segment, then run this recipe to unfreeze its sidechains 
--  (workaround for the fact you can't unfreeze sidechains manually, even if they add that, it'd take ages)

for i = 1 , structure.GetCount () do
    if ( freeze.IsFrozen ( i ) == false ) then
        freeze.Unfreeze ( i , true , true ) --unfreeze sidechains
    end
end

Comments

[StackOverflow]

When you freeze the whole protein, then unfreeze a section, the sidechains still remain frozen.

This is a one-click script to unfreeze those sidechains for you.

[Bruno Kestemont]

You could call it "unfreeze sidechains"