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Gaussian Accelerated Molecular Dynamics: Unconstrained Enhanced Sampling  and Free Energy Calculation | Journal of Chemical Theory and Computation
Gaussian Accelerated Molecular Dynamics: Unconstrained Enhanced Sampling and Free Energy Calculation | Journal of Chemical Theory and Computation

Relative Binding Free Energy Calculations in Drug Discovery: Recent  Advances and Practical Considerations | Journal of Chemical Information and  Modeling
Relative Binding Free Energy Calculations in Drug Discovery: Recent Advances and Practical Considerations | Journal of Chemical Information and Modeling

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Open Binding Pose Metadynamics: An Effective Approach for the Ranking of  Protein–Ligand Binding Poses | Journal of Chemical Information and Modeling
Open Binding Pose Metadynamics: An Effective Approach for the Ranking of Protein–Ligand Binding Poses | Journal of Chemical Information and Modeling

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Population Based Reweighting of Scaled Molecular Dynamics | The Journal of Physical Chemistry B

Application of Molecular-Dynamics Based Markov State Models to Functional  Proteins | Journal of Chemical Theory and Computation
Application of Molecular-Dynamics Based Markov State Models to Functional Proteins | Journal of Chemical Theory and Computation

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Optimized Hydrogen Mass Repartitioning Scheme Combined with Accurate Temperature/Pressure Evaluations for Thermodynamic and Kinetic Properties of Biological Systems | Journal of Chemical Theory and Computation

Relative Binding Free Energy Calculations in Drug Discovery: Recent  Advances and Practical Considerations | Journal of Chemical Information and  Modeling
Relative Binding Free Energy Calculations in Drug Discovery: Recent Advances and Practical Considerations | Journal of Chemical Information and Modeling

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Hippocampal dysfunction in the pathophysiology of schizophrenia: a  selective review and hypothesis for early detection and intervention |  Molecular Psychiatry
Hippocampal dysfunction in the pathophysiology of schizophrenia: a selective review and hypothesis for early detection and intervention | Molecular Psychiatry

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