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Alchemical Grid Dock (AlGDock) calculations in the D3R Grand Challenge 3 - Binding free energies between flexible ligands and rigid receptors

Bing Xie, David D. L. Minh. Alchemical Grid Dock (AlGDock) calculations in the D3R Grand Challenge 3 - Binding free energies between flexible ligands and rigid receptors. Journal of Computer-Aided Molecular Design, 33(1):61-69, 2019. [doi]

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