[gmx-users] Question on forcefields?

sujithkakkat . sujithks58 at gmail.com
Sun Feb 8 12:18:31 CET 2015

Dear all,

    Is it possible that a model for a simple molecule (say CO2) which can
accurately predict macroscopic properties (like density), but still can
have error in the microscopic behavior, like diffusivity or the pair
interaction functions ? Please share your thoughts.



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