Deep Learning to Generate in Silico Chemical Property Libraries and Candidate Molecules for Small Molecule Identification in Complex Samples

Journal Article
Analytical Chemistry, vol. 92, iss. 2, pp. 1720-1729, 2019
Authors
Sean M. Colby, Jamie R. Nuñez, Nathan O. Hodas, Courtney D. Corley, Ryan R. Renslow
English