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Table 8 Activity predictions and statistics for considered datasets

From: Mol-CycleGAN: a generative model for molecular optimization

ZINC-250K predicted mean activity0.223
\(X_{\text {test}}\) predicted mean activity0.179
\(G(X_{\text {test}})\) predicted mean activity0.362
Mean gain in predicted activity0.182
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Journal of Cheminformatics

ISSN: 1758-2946

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