[gmx-users] setting up a random system

Dallas B. Warren Dallas.Warren at vcp.monash.edu.au
Mon Jul 10 05:31:28 CEST 2006


> About that pressure scaling problem what is the importance of 
> tau_p? What does it mean if I change it from 1 to 100 for example?

Coupling constant.  See equation 3.29 in manual

1 to 100 will mean that the pressure will scale 100 times slower.  Lower
the number, faster the response and adjustements to the pressure.

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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