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Table 5 Results of Stages 2 and 3 in Phase 1

From: A novel method for inference of acyclic chemical compounds with bounded branch-height based on artificial neural networks and integer programming

\(\pi \) K Activation Architecture L-Time test \(\hbox {R}^2\) (ave.) test \(\hbox {R}^2\) (best)
Kow 76 ReLU (76, 10, 1) 2.12 0.901 0.951
Bp 76 ReLU (76, 10, 1) 26.07 0.935 0.965
Hc 68 ReLU (68, 10, 1) 234.06 0.924 0.988