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. 2022 Aug 16;14(8):1710. doi: 10.3390/pharmaceutics14081710

Table 3.

Model utilities by the configurations and the training datasets used.

Dataset BIOSNAP
(BS)
DAVIS
(DV)
BindingDB
(BDB)
Integration
(INT)
Non-pretrained (NP) (ϕ + ϕ) NP-Model-BS NP-Model-DV NP-Model-BDB NP-Model-INT
ChemBERTa-pretrained (CP) (ChemBERTa + ϕ) CP-Model-BS CP-Model-DV CP-Model-BDB CP-Model-INT
ProtBERT-pretrained (PP) (ϕ + ProtBERT) PP-Model-BS PP-Model-DV PP-Model-BDB PP-Model-INT
Full-pretrained (FP) (ChemBERTa + ProtBERT) FP-Model-BS FP-Model-DV FP-Model-BDB FP-Model-INT

Note: ϕ indicates the model that did not employ the pretrained weights of the ChemBERTa and ProtBert models. Integration refers to a model trained by merging the three datasets.