Autonomous, multiproperty-driven molecular discovery: from predictions to measurements and back

Autonomous, multiproperty-driven molecular discovery: from predictions to measurements and back

This repository contains all the data and models associated with the paper "Autonomous, multi-property-driven molecular discovery: from predictions to measurements and back" by Koscher et al. More information to follow

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Bibliographische Detailangaben
Hauptverfasser: Koscher, Brent, Canty, Richard, McDonald, Matthew, Greenman, Kevin, McGill, Charles, Bilodeau, Camille, Jin, Wengong, Wu, Haoyang, Vermeire, Florence, Jin, Brooke, Hart, Travis, Kulesza, Timothy, Li, Shih-Chen, Jaakkola, Tommi, Barzilay, Regina, Gomez-Bombarelli, Rafael, Green, William, Jensen, Klavs
Format: Dataset
Sprache:eng
Online-Zugang:Volltext bestellen
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Beschreibung
Zusammenfassung:This repository contains all the data and models associated with the paper "Autonomous, multi-property-driven molecular discovery: from predictions to measurements and back" by Koscher et al. More information to follow
DOI:10.5281/zenodo.10037800