Dear All,
we would like to run a MD with a few NMR derived distance restraints. Could this be done with the SA protocolls for NMR structure calculation? Or would the non-contrained parts be problematic during high T dynamics of SA? Is there any recommended protocoll for such partially contrained RMD?
Thanks for any thoughts!
Krisztina
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Fri Apr 26 2013 - 07:00:03 PDT
