Identification of Potential WSB1 Inhibitors by AlphaFold Modeling, Virtual Screening, and Molecular Dynamics Simulation Studies

<div>Average RMSD of WSB1 during running 3 × 10 ns metadynamics. The first column of numbers is the number of candidate poses; the second column is the score of PersScore; and the third column is the score of PoseScore.</div>

Evidence-Based Complementary and Alternative Medicine

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Figure 3

Figure 3: Identification of Potential WSB1 Inhibitors by AlphaFold Modeling, Virtual Screening, and Molecular Dynamics Simulation Studies 