Autonomous, multiproperty-driven molecular discovery: from predictions to measurements and back
DOI10.5281/zenodo.10037801Zenodo10037801MaRDI QIDQ6693450FDOQ6693450
Dataset published at Zenodo repository.
Haoyang Wu, Klavs F. Jensen, Timothy Kulesza, Rafael Gomez-Bombarelli, Richard Canty, Matthew McDonald, Brooke Jin, Wengong Jin, Kevin P. Greenman, Charles J. McGill, William H. Green, Tommi Jaakkola, Regina Barzilay, Travis Hart, Shih-Chen Li, Florence Vermeire, Camille Bilodeau, Brent Koscher
Publication date: 22 December 2023
Copyright license: Creative Commons Attribution 4.0 International
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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