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. 2021 May 24;61(6):2523–2529. doi: 10.1021/acs.jcim.1c00103

Figure 1.

Figure 1

Input parameters tab (on the left) includes the (A) “Input Receptor and Ligand Files” and (B) “Molecular Viewer” subsections, as well as the (C) save/load and “Start DeepFrag” buttons. The Output tab (on the right) includes the (D) suggested-fragments table and (E) “Output Files” subsections. Some components are not shown to simplify the presentation.