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. 2022 May 22;36(4):263–277. doi: 10.1007/s10822-022-00443-8

Fig. 8.

Fig. 8

Bar graphs showing the relevant statistics for each QM/MM submission, as well as the associated classical (FM) submission for which QM/MM corrections were added. Results for the FM submissions are outlined in black, and the QM/MM blurred results are translucent