Pattanaik, L.

Authored

(621g) An End-to-End Workflow for Diverse Transition State Conformer Generation Using Machine Learning
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)
(509ct) An Automated Workflow to Rapidly and Accurately Generate Transition State Structures Using Machine Learning
2021 Annual Meeting (ISBN: 978-0-8169-1116-5)
(731c) Towards Fully Automated Generation of Predictive Detailed Kinetic Models: 2,3-Dimethylbut-2-Ene Oxidation Modeling As an Example
2021 Annual Meeting (ISBN: 978-0-8169-1116-5)

Related Proceedings

2021 Annual Meeting2022 Annual Meeting