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Table 1 A comparison of modified drug-likeness optimization results by the MolFinder, ReLeaSE and MolDQN methods

From: MolFinder: an evolutionary algorithm for the global optimization of molecular properties and the extensive exploration of chemical space using SMILES

  ZINC MolFinder MolFinder-local ReLeaSE MolDQN
Mean 0.7086 0.9237 0.9240 0.8473 0.8677
Std. 0.1248 0.0020 0.0027 0.0380 0.0240
Min. 0.3263 0.9209 0.9199 0.7570 0.8281
Max. 0.9224 0.9316 0.9326 0.9317 0.9235
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Journal of Cheminformatics

ISSN: 1758-2946

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