Ligand-based discovery of coronavirus main protease inhibitors using MACAW molecular embeddings

Jie Donga Xiangya School of Pharmaceutical Sciences, Central South University, Changsha, P. R. China

https://orcid.org/0000-0002-3324-9000 View further author information

Mihayl Varbanovb Université de Lorraine, CNRS, Nancy, France;c Laboratoire de Virologie, CHRU de Nancy Brabois, Vandoeuvre-lès-Nancy, FranceView further author information

Stéphanie Philippotb Université de Lorraine, CNRS, Nancy, FranceView further author information

Fanny Vrekenb Université de Lorraine, CNRS, Nancy, FranceView further author information

Wen-bin Zenga Xiangya School of Pharmaceutical Sciences, Central South University, Changsha, P. R. ChinaView further author information

Vincent Blayd Department of Microbiology and Environmental Toxicology, University of California at Santa Cruz, Santa Cruz, CA, USACorrespondence[email protected]

https://orcid.org/0000-0001-9602-2375 View further author information

Ligand-based discovery of coronavirus main protease inhibitors using MACAW molecular embeddings

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