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. 2020 Oct 27;35(4):433–451. doi: 10.1007/s10822-020-00354-6

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© The Author(s) 2020

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Fig. 11 — Ligand Interaction diagram for the ligand ID 4CK in the PDB structure 4FKG after the QM/MM and conventional PHENIX refinements. Arrows added to underscore significant structural and interaction changes