[AMBER] Restraint on certain atoms during MD

From: Debarati DasGupta <debarati_dasgupta.hotmail.com>
Date: Tue, 21 Apr 2020 12:45:15 +0000

I get this error when running the minimimization of a protein in water

   [cid:image001.png.01D617B9.2CBC12C0]

This is my restraintmask = ':1,:2-272.CA,C,N,:273,:274',
Cant find the error....




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Received on Tue Apr 21 2020 - 06:00:02 PDT