Science Advances

Supplementary Materials

This PDF file includes:

  • Derivation of the basic metainference equations
  • Details of the model system simulations
  • Details of the ubiquitin MD simulations
  • Fig. S1. Effect of prior accuracy on the error of the metainference method.
  • Fig. S2. Scaling of metainference error with the number of replicas at varying levels of noise in the data.
  • Fig. S3. Scaling of metainference error with the number of states.
  • Fig. S4. Accuracy of the outliers model.
  • Table S1. Comparison of the quality of the ensembles obtained using different modeling approaches in the case of the native state of the protein ubiquitin.
  • Table S2. Comparison of the stereochemical quality of the ensembles or single models generated by the approaches defined in table S1.
  • References (39–45)

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