[gmx-users] Fatal Equilibration Errors

Dallas B. Warren Dallas.Warren at pharm.monash.edu.au
Tue Aug 11 03:34:11 CEST 2009

You might want to consider the parameters I developed for propylene
glycol .... http://dx.doi.org/10.1021/mp8001667 ... might provide some
guidance for you in terms of the parameterisation of ethylene glycol.

Catch ya,

Dr. Dallas Warren
Department of Pharmaceutical Biology 
Pharmacy and 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.

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