Martini 3 coarse‐grained force field: small molecules

HIGHLIGHTS

• who: Small Molecules et al. from the Zernike Institute University of Nijenborgh, Groningen , AG, The Netherlands have published the research: Martini 3 Coarse‐Grained Force Field: Small Molecules, in the Journal: (JOURNAL)
• what: The authors propose that vapor-liquid equilibrium data can be used to further validate the miscibility of phases relevant to a certain application of the Martini force_field.
• how: For this analysis the authors used for each bead the mass of the constituting atoms rather than the typical bead masses that were used for the simulation. The benzene- chloroform mixture has . . .
  

   

  

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