From: Gareth Shannon (paxgs1_at_nottingham.ac.uk)
Date: Tue Dec 11 2012 - 12:08:21 CST
May I ask if anyone has ever performed replica exchange with solute tempering (REST) (Pu Liu, Byungchan Kim, Richard A. Friesner, B. J. Berne. Proceedings of the National Academy of Sciences of the United States of America, Vol. 102, No. 39. (2005)) or replica exchange statistical temperature molecular dynamics (RESTMD)(Jaegil Kim, John E. Straub and Tom Keyes. The Journal of Physical Chemistry B. 116 (2012)) in NAMD?
NASA Assistant Specialist
This message and any attachment are intended solely for the addressee and may contain confidential information. If you have received this message in error, please send it back to me, and immediately delete it. Please do not use, copy or disclose the information contained in this message or in any attachment. Any views or opinions expressed by the author of this email do not necessarily reflect the views of the University of Nottingham.
This message has been checked for viruses but the contents of an attachment
may still contain software viruses which could damage your computer system:
you are advised to perform your own checks. Email communications with the
University of Nottingham may be monitored as permitted by UK legislation.
This archive was generated by hypermail 2.1.6 : Mon Dec 31 2012 - 23:22:21 CST