Clyde, Austin

2 publications

NeurIPSW 2022 Deep Surrogate Docking: Accelerating Automated Drug Discovery with Graph Neural Networks Ryien Hosseini, Filippo Simini, Austin Clyde, Arvind Ramanathan

ICLR 2022 Spatial Graph Attention and Curiosity-Driven Policy for Antiviral Drug Discovery Yulun Wu, Nicholas Choma, Andrew Deru Chen, Mikaela Cashman, Erica Teixeira Prates, Veronica G Melesse Vergara, Manesh B Shah, Austin Clyde, Thomas Brettin, Wibe Albert de Jong, Neeraj Kumar, Martha S Head, Rick L. Stevens, Peter Nugent, Daniel A Jacobson, James B Brown