"Direct Optimization across Computer-Generated Reaction Networks Balances ..."

Hanyu Gao et al. (2021)

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DOI: 10.1021/ACS.JCIM.0C01032

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type: Journal Article

metadata version: 2023-03-21

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Hanyu Gao, Jean Pauphilet, Thomas J. Struble, Connor W. Coley, Klavs F. Jensen:
Direct Optimization across Computer-Generated Reaction Networks Balances Materials Use and Feasibility of Synthesis Plans for Molecule Libraries. J. Chem. Inf. Model. 61(1): 493-504 (2021)

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