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Table 4 Results of Stage 1 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

\(\pi \)

\(\Lambda \)

\(|D_{\pi }|\)

\(|\Gamma |\)

\([{\underline{n}},{\overline{n}}]\)

\([\underline{{\text {bl}}},\overline{{\text {bl}}}]\)

\([\underline{\text {bh}},\overline{\text {bh}}]\)

\([{\underline{a}},{\overline{a}}]\)

Kow

C,O,N

216

10

[4, 28]

[0, 2]

[0, 4]

[− 4.2, 8.23]

Bp

C,O,N

172

10

[4, 26]

[0, 1]

[0, 3]

[− 11.7, 404.84]

Hc

C,O,N

128

6

[4, 26]

[0, 1]

[0, 2]

[1346.4, 13304.5]