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Construction of the subtree for the best leaf of thrombin Coulomb contact dataset.
Notes: Number of compounds in the main tree: 2357, in the subtree: 212. (A) Fingerprints for the vectors of the main tree (left) and of the subtree for the best leaf of the main tree (right). (B) AuPosSOM scoring ROC curve for the Coulomb contact subtree dataset.
