[gmx-users] Measuring dihedral energy of various selections

[kobi]

Thanks a lot! Sometimes it can be sooo easy....

ciao
Jan Neumann

>> may I ask how do you get the potential energies from a 
>> simulation? Is it possible to get continuous energy-time 
>> graph for a system?
>>     
>
> Use the script g_energy on the .edr file from the simulation.
>
> Catch ya,
>
> Dr. Dallas Warren
> Lecturer
> Department of Pharmaceutical Biology and Pharmacology
> Victorian College of Pharmacy, Monash University
> 381 Royal Parade, Parkville VIC 3010
> dallas.warren at vcp.monash.edu.au
> +61 3 9903 9524
> ---------------------------------
> When the only tool you own is a hammer, every problem begins to resemble
> a nail.
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