Small Molecules

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An extensive collection of Martini 3 topologies for small molecules is available below. For more information regarding these models, the parametrization strategy and the recommended best practices for using them, please refer to the GitHub repository [here].

• Alessandri R., et. al.. Martini 3 Coarse-Grained Force Field: Small Molecules. Adv. Theory Simul., 2022.
  (doi: 10.1002/adts.202100391)

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• martini_v3.0.0_small_molecules_v1.itp | (original release)

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