Hi, I am trying to remove thermostat on a certain group of atoms by taking tau_t = 0. But upon using grompp it says:
"For proper thermostat integration tau_t (0) should be more than an order of magnitude larger than delta_t." And gives a warning. This was not there in v3.3. Is this a bug or should I ignore it? Thanks, Manik -- _________________ HAPAX LEGOMENA
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