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. 2020 Feb 1;53(Pt 1):226–235. doi: 10.1107/S1600576719014092

Figure 10.

Figure 10

Conformer generation for the molecule omeprazole, starting from (a) the molecular conformation in a known crystal structure (CSD refocde VAYXOI; Ohishi et al., 1989) and generating (b) a diverse conformer ensemble including the 15 highest ranked conformers.