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Fig. 5 | Journal of Cheminformatics

Fig. 5

From: MolFilterGAN: a progressively augmented generative adversarial network for triaging AI-designed molecules

Fig. 5

Comparison of the molecular filtering procedures and results on the same set of 30,000 GENTRL-generated compounds reported by Zhavoronkov et al. a Venn diagram showing the top-ranked six compounds selected by Zhavoronkov et al. (light green square), docking (light blue square), and MolFilterGAN + docking (light gold square). Flowcharts comparing the molecular filtering procedures of b Zhavoronkov et al. and c MolFilterGAN + docking

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Journal of Cheminformatics

ISSN: 1758-2946

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