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Table 6 Descriptors and regression coefficients of the best model for cyclic peptide drugs obtained by ELS trained on small molecule training data

From: Computational prediction of plasma protein binding of cyclic peptides from small molecule experimental data using sparse modeling techniques

Descriptor

Category

Regression coef.

Radial centric

Topological descriptors

0.06

PEOE6

Physical property

0.10

PISA

Physical property

0.11

QPLogPo/w

Physical property

0.25