AMBER: Temperature varible in MMPBSA script

From: JunJun Liu <>
Date: Fri, 01 Jul 2005 21:59:05 +0800

Dear AMBER users:

The default temperature in nmode calculation is 298.15K, while the
temperature varible in MM-PBSA script, which is used to calculate "TS", is
300K. Could anyone of you please tell me why not set the temperatrue
varible in MM-PBSA script to 298.15K as default? Thanks in advance!

Best Regards!


JunJun Liu
College of Chemistry
Central China Normal University
WuHan   430079
P.R. China
The AMBER Mail Reflector
To post, send mail to
To unsubscribe, send "unsubscribe amber" to
Received on Fri Jul 01 2005 - 15:53:00 PDT
Custom Search