Search Results - Osato, Meghan

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  1. 1
    Temperature artifacts in protein structures bias ligand-binding predictions

    Temperature artifacts in protein structures bias ligand-binding predictions by Bradford, Shanshan Y. C, El Khoury, Léa, Ge, Yunhui, Osato, Meghan, Mobley, David L, Fischer, Marcus

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  2. 2
    PopShift: A Thermodynamically Sound Approach to Estimate Binding Free Energies by Accounting for Ligand-Induced Population Shifts from a Ligand-Free Markov State Model

    PopShift: A Thermodynamically Sound Approach to Estimate Binding Free Energies by Accounting for Ligand-Induced Population Shifts from a Ligand-Free Markov State Model by Smith, Louis G., Novak, Borna, Osato, Meghan, Mobley, David L., Bowman, Gregory R.

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  3. 3
    Fragment Pose Prediction Using Non-equilibrium Candidate Monte Carlo and Molecular Dynamics Simulations

    Fragment Pose Prediction Using Non-equilibrium Candidate Monte Carlo and Molecular Dynamics Simulations by Lim, Nathan M, Osato, Meghan, Warren, Gregory L, Mobley, David L

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