CCL: How is the Pressure calculation in tanker 4.2?
- From: "Amir Taghavi"
<amirtaghavi:-:khayam.ut.ac.ir>
- Subject: CCL: How is the Pressure calculation in tanker 4.2?
- 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