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. 2023 Mar 6;45(3):2136–2156. doi: 10.3390/cimb45030137

Table 6.

Steered molecular dynamics of 4 leads.

Flavonoid Time Taken to Dissociate the Ligand (ps)
BI-2852 (reference) 51.162
L1 32.067
L2 41.805
L3 89.435
L4 44.557