[gmx-users] Lateral pressure profile in membrane simulations

[Dallas B. Warren]

Isn't that already present in the energy file, .edr, from the run?
Simply use g_energy to extract it.

 

Catch ya,

Dr. Dallas Warren
Drug Delivery, Disposition and Dynamics
Monash Institute of Pharmaceutical Sciences, Monash University
381 Royal Parade, Parkville VIC 3010
dallas.warren at pharm.monash.edu.au
+61 3 9903 9167
---------------------------------
When the only tool you own is a hammer, every problem begins to resemble
a nail. 

 

From: gmx-users-bounces at gromacs.org
[mailto:gmx-users-bounces at gromacs.org] On Behalf Of Fernando E. Herrera
Sent: Thursday, 8 April 2010 8:45 AM
To: gmx-users at gromacs.org
Subject: [gmx-users] Lateral pressure profile in membrane simulations

 

Dear users:

I am doing some molecular dynamics simulations of membrane systems and i
would like to ask you if someone know or have a code for the calculation
of the lateral pressure profile  from the data obtained doing  membrane
simulations.
Thank you very much in advance,

Fernando
 

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