Estimation of Protein-Ligand Unbinding Kinetics Using Non-Equilibrium Targeted Molecular Dynamics Simulations
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Estimation of Protein-Ligand Unbinding Kinetics Using Non-Equilibrium Targeted Molecular Dynamics Simulations Descriptor: 4-[2-(2-chlorophenyl)pyrazol-3-yl]benzene-1,3-diol, Heat shock protein HSP 90-alpha Authors: Musil, D, Lehmann, M, Eggenweiler, H.-M. Deposit date: 2017-12-20 Release date: 2019-01-30 Last modified: 2024-05-08 Method: X-RAY DIFFRACTION (2.49 Å) Cite: Estimation of Protein-Ligand Unbinding Kinetics Using Non-Equilibrium Targeted Molecular Dynamics Simulations Arxiv, 2019
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2017-12-20
