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Table 7 Results of the inference phase for the dataset Duffy

From: A unified approach to inferring chemical compounds with the desired aqueous solubility

Inst.

\(n_{\text{LB}} \)

\( \underline{y^*},~\overline{y^*} \)

\(\#\)

\(\#\)c  

I-time

n

\(\eta (f({\mathbb {C}}^{\dagger }))\)

\(I_{\text{a}}\)

30

\(-11.5, -11.45\)

10535

9035

16.646

42

\(-11.498\)

\(I_{\text{b}}^1\)

35

\(-10.9, -10.85 \)

10717

6647

12.458

35

\(-10.869\)

\(I_{\text{b}}^2\)

45

\(-8.4, -8.35\)

13536

9767

65.218

50

\(-8.39\)

\(I_{\text{b}}^3\)

45

\(-3.95, -3.9\)

13337

9773

31.167

50

\(-3.936\)

\(I_{\text{b}}^4\)

45

\(-14.45, -14.4\)

13138

9778

91.762

49

\(-14.432\)

\(I_{\text{c}}\)

50

\(-10.1, -10.05\)

6651

6981

6.328

50

\(-10.054\)

\(I_{\text{d}}\)

40

\(-8.05, -8\)

5271

6482

18.634

44

\(-8.018\)