PANTHER Score: Protein-Affinity for Nucleic Target-binding, Hybridization, and Energy Regression

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FIGURE 1.
FIGURE 1.

Schematic representation of the data set preparation and validation workflow. Protein–RNA complexes with and without experimental ΔG values were subjected to MD simulations, followed by the local-to-global energy strategy to compute the MD-derived PANTHER Scores. The validated scores were used to construct the final training and test sets for ML model development and validation.

This Article

  1. RNA 32: 131-149