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Exploring ligand stability in protein crystal structures us..:

Fusani, Lucia ; Palmer, David S ; Somers, Donald O.
https://strathprints.strath.ac.uk/71146/7/Fusani_etal_JCIM2020_Exploring_ligand_stability_in_protein_crystal_structures_using_binding_pose_metadynamics.pdf.  , 2020