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.war...@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-boun...@gromacs.org [mailto:gmx-users-boun...@gromacs.org] On Behalf Of Fernando E. Herrera Sent: Thursday, 8 April 2010 8:45 AM To: gmx-users@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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