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Beilstein J. Org. Chem. 2023, 19, 1933–1946, doi:10.3762/bjoc.19.144
Graphical Abstract
Figure 1: Graphical representation of ligands (in licorice, hydrogen atoms not shown) used in this study. Lig...
Figure 2: RMSD values obtained using the cpptraj script from AMBER suite for 1BFC (basic fibroblast factor) c...
Figure 3: Graphical representation of the ligands’ starting (in red, licorice) and final (in blue, licorice) ...
Figure 4: Graphical representation of the ligand’s starting (in red, licorice) and final (in blue, licorice) ...
Figure 5: Graphical representation of the ligand 4 starting (in red, licorice) and final (in blue, licorice) ...
Figure 6: Comparison of the last frame of the US simulation (orange, licorice) with the chondroitin sulfate l...
Figure 7: The X-ray conformation of bFGF-HP dp6 (PDB ID: 1BFC) and windows 5 and 10 and windows 6, 8, 10 in t...