AMBER Archive (2005)

Subject: AMBER: How to add water to calculate MMPBSA

From: Kitiyaporn Wittayanarakul (mameow50_at_yahoo.com)
Date: Wed Dec 14 2005 - 12:06:53 CST


Hi,
  Due to when calculate MMPBSA, it's not include water molecule. So I'd to add the water molecule and then doing MMPBSA calculation. I'm wodering if it has the tutorial website ortherwise how to know to set up this system. Please help me to find out this problem.
  Thank you in advance.
  Wittayanarakul K.

                        
---------------------------------
Yahoo! Shopping
 Find Great Deals on Holiday Gifts at Yahoo! Shopping
-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber_at_scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo_at_scripps.edu