From: Sabine Leroch (sabine.leroch_at_boku.ac.at)
Date: Wed Jul 15 2009 - 07:48:07 CDT
>>> Sabine Leroch 7/13/2009 2:36 PM >>>
I am new to NAMD, as I found nothing related in the mailing list, I have to post following question. I need to simulate the adsorption of aminoacids in water at a graphite wall. As it is computationally very costly to use an atomic graphite slide, I want to represent the wall by a smeart out Steele 9/3 LJ potential. Is this possible with NAMD? If yes, how can I set the command in the input file?
Thank you very much
This archive was generated by hypermail 2.1.6 : Wed Feb 29 2012 - 15:53:02 CST