AMBER Archive (2005)

Subject: AMBER: Replica exchange

From: Anthony Cruz (acb15885_at_uprm.edu)
Date: Wed Aug 24 2005 - 12:57:42 CDT

Hi Users:
I want to run a replica exchange simulation of polypeptide unfolding. How I
could make a solvatation box as big as the protein unfolded??? What could be
better implicit or explicit solvatation???

Best regards
Anthony
-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber_at_scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo_at_scripps.edu