[AMBER] predicting RDCs for un-restrained bonds

From: Thomas Pochapsky <pochapsk.brandeis.edu>
Date: Mon, 11 Jul 2016 09:23:03 -0400

Hello, all.

Is there a way of getting a listing of predicted RDC values for all NH
bonds in a protein given a best-fit alignment tensor, even if there
aren't restraints on all NH bonds?


Tom Pochapsky

AMBER mailing list
Received on Mon Jul 11 2016 - 06:30:02 PDT
Custom Search