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. 2023 Nov 17;14:1291868. doi: 10.3389/fmicb.2023.1291868

Table 2.

Binding affinity between vaccine molecules and TLRs by the ClusPro and HDOCK servers.

TLRs Vaccine ClusPro Docking Score (kcal/mol) HDOCK Docking Score (kcal/mol)
TLR2 V1 −1005.2 −292.86
V2 −974.1 −288.36
TLR3 V1 −1026.3 −377.57
V2 −1290.8 −356.74
TLR9 V1 −1337.7 −358.13
V2 −1161.7 −430.55

A greater negative score indicates high binding affinity in this docking study.