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. 2023 Mar 23;14:1148670. doi: 10.3389/fphar.2023.1148670

TABLE 5.

Number of compounds of the external validation set inside the applicability domain according to each strategy and the consensus approach.

Model Similarity PCA range Euclidean distance Probability density Consensus
LB 97 187 320 276 217
LiGen BP 97 296 318 304 298
LiGen BP-LB 97 153 320 243 183
LiGen AV 97 291 319 299 292
LiGen AV-LB 97 181 320 275 216