A molecular representation system with a common reference frame for natural products pathway discovery and structural diversity tasks

Nicole Babineau; Le Thanh Dien Nguyen; Davis Mathieu; Clint McCue; Nicholas Schlecht; Taylor Abrahamson; Björn Hamberger; Lucas Busta

doi:10.1101/2024.10.01.616173

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A molecular representation system with a common reference frame for natural products pathway discovery and structural diversity tasks

Nicole Babineau, Le Thanh Dien Nguyen, Davis Mathieu, Clint McCue, Nicholas Schlecht, Taylor Abrahamson, Björn Hamberger, Lucas Busta

doi: https://doi.org/10.1101/2024.10.01.616173

Nicole Babineau

aDepartment of Chemistry and Biochemistry, University of Minnesota Duluth, Duluth, Minnesota, USA

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Le Thanh Dien Nguyen

aDepartment of Chemistry and Biochemistry, University of Minnesota Duluth, Duluth, Minnesota, USA

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Davis Mathieu

bGenetics and Genome Science Graduate Program, Michigan State University, East Lansing, Michigan, USA

cDepartment of Biochemistry and Molecular Biology, Michigan State University, East Lansing, Michigan, USA

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Clint McCue

aDepartment of Chemistry and Biochemistry, University of Minnesota Duluth, Duluth, Minnesota, USA

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Nicholas Schlecht

cDepartment of Biochemistry and Molecular Biology, Michigan State University, East Lansing, Michigan, USA

dGreat Lakes Bioenergy Research Center, Michigan State University, East Lansing, Michigan, USA

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Taylor Abrahamson

aDepartment of Chemistry and Biochemistry, University of Minnesota Duluth, Duluth, Minnesota, USA

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Björn Hamberger

bGenetics and Genome Science Graduate Program, Michigan State University, East Lansing, Michigan, USA

cDepartment of Biochemistry and Molecular Biology, Michigan State University, East Lansing, Michigan, USA

dGreat Lakes Bioenergy Research Center, Michigan State University, East Lansing, Michigan, USA

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Lucas Busta

aDepartment of Chemistry and Biochemistry, University of Minnesota Duluth, Duluth, Minnesota, USA

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For correspondence: bust0037@d.umn.edu

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A molecular representation system with a common reference frame for natural products pathway discovery and structural diversity tasks

Nicole Babineau, Le Thanh Dien Nguyen, Davis Mathieu, Clint McCue, Nicholas Schlecht, Taylor Abrahamson, Björn Hamberger, Lucas Busta

bioRxiv 2024.10.01.616173; doi: https://doi.org/10.1101/2024.10.01.616173

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A molecular representation system with a common reference frame for natural products pathway discovery and structural diversity tasks

Nicole Babineau, Le Thanh Dien Nguyen, Davis Mathieu, Clint McCue, Nicholas Schlecht, Taylor Abrahamson, Björn Hamberger, Lucas Busta

bioRxiv 2024.10.01.616173; doi: https://doi.org/10.1101/2024.10.01.616173

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