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Galaxy workflows for fragment-based virtual screening: a case study on the SARS-CoV-2 main protease

Simon Bray, Tim Dudgeon, Rachael Skyner, Rolf Backofen, Björn A. Grüning, Frank von Delft. Galaxy workflows for fragment-based virtual screening: a case study on the SARS-CoV-2 main protease. J. Cheminformatics, 14(1):22, 2022. [doi]

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Simon Bray

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Tim Dudgeon

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Rachael Skyner

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Rolf Backofen

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Björn A. Grüning

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Frank von Delft

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