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Table 8 Results of the inference phase for the dataset Wang

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

Inst.

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

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

\(\#\)v

\(\#\)c

I-time

n

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

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

30

\(-6, -5\)

11212

10504

25.871

35

\(-5.911\)

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

35

\(-2.5, -2.45\)

15015

8633

962.451

35

\(-2.471\)

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

45

\(-2.8, -2.3\)

18943

11747

338.681

50

\(-2.35\)

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

45

\(-2, -1.5\)

18784

11747

251.548

50

\(-1.583\)

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

45

\(-2.8, -2.351\)

18624

11746

751.557

50

\(-2.3\)

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

50

\(-4.5, -3.5\)

7319

8435

224.792

50

\(-3.836\)

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

40

\(-5, -4\)

5942

7940

13.319

42

\(-4.475\)