From owner-chemistry $#at#$ ccl.net Sun Dec 28 16:14:00 2008
From: "Amir Taghavi amirtaghavi:khayam.ut.ac.ir" <owner-chemistry!=!server.ccl.net>
To: CCL
Subject: CCL: How is the Pressure calculation in tanker 4.2?
Message-Id: <-38371-081228150004-25399-9Mn8eBeOvKthsqLZDbviHw!=!server.ccl.net>
X-Original-From: "Amir  Taghavi" <amirtaghavi:-:khayam.ut.ac.ir>
Date: Sun, 28 Dec 2008 15:00:00 -0500


Sent to CCL by: "Amir  Taghavi" [amirtaghavi[*]khayam.ut.ac.ir]

Greetings,
How can I calculate the pressure, when I run my molecular dynamic simulation in an NVT ensemble?
Is it possible to run a constant-NVT canonical molecular dynamic simiulation under a given pressure in tinker?
Please guide me
Best Regards