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High-throughput Computational Workflow for Ligand Discovery in Catalysis with th...
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High-throughput Computational Workflow for Ligand Discovery in Catalysis with th...
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Article in Journal/Newspaper
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Nguyen, Bao N.
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Short, Marc A. S.
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Tovee, Clare A.
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Willans, Charlotte E.
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Cambridge Structural Database
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Catalyst Design
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Copper catalysis
High-throughput calculation
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Semi-automated workflow
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DataCite Metadata Store (German National Library of Science and Technology)
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Orca
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