AMBER: question about initial conditions for amber

From: Ed Pate <pate.math.wsu.edu>
Date: Sun, 29 May 2005 19:42:21 -0700 (PDT)

Amber community:

I have a question about the initial conditions that are used for an Amber
molecular dynamics simulation. The molecule structure gives you the
initial position. Is the initial velocity for each atom assumed to be
zero, or is it taken from some distribution?

Thank you for your help.

Ed Pate

-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber.scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo.scripps.edu
Received on Mon May 30 2005 - 03:53:00 PDT
Custom Search