[gmx-users] Strong egative energy drift (losing energy) in explicit water AMBER protein simulation [SOLVED]

ms devicerandom at gmail.com
Fri Jun 15 12:53:12 CEST 2012

Ok, I am using v-rescale now and the major artefacts seem to be gone, at 
least on the very short term (2-3 ns).

It seems grompp should warn that andersen is not a good choice if you're 
using CPUs :)


Massimo Sandal, Ph.D.

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