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December 2013

2 participants
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RMSD between sets of particles
by Davide Baù 11 Dec '13

11 Dec '13

Hi, is there a way of getting the RMSD between two set of particles (not atoms)? I'd like to create a score based on the RMSD between two models in order to decide when to stop a Molecular Dynamics (or Brownian Dynamics) simulation. Thanks, Davide

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