Jaakkola, T. S.

Authored

(687e) Chemprop: Machine Learning for Molecular Property Prediction
2022 Annual Meeting (ISBN: 978-0-8169-1118-9)
(364j) Generating 3D Conformer Ensembles of Molecular Graphs with End-to-End Differentiable Networks
2021 Annual Meeting (ISBN: 978-0-8169-1116-5)
(140b) Learning to Design and Validate Small-Molecule Synthetic Routes from Historical Reaction Data
2018 AIChE Annual Meeting (ISBN: 978-0-8169-1108-0)

Related Proceedings

2018 AIChE Annual Meeting2021 Annual Meeting2022 Annual Meeting