Hi I am trying to simulate a system contains two identical protein chains. I am equilibrating the system at 7 different temperatures. All the nvt ones have completed without any errors. 5 npt ones are also completed but in case of two highest temperatures 679.35 k and 800.0 k it is showing this following error "2 particles communicated to PME rank 2 are more than 2/3 times the cut-off out of the domain decomposition cell of their charge group in dimension x. This usually means that your system is not well equilibrated."
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