Publications

October 5, 2018
Deep learning and virtual drug screening
Kristy A Carpenter, David S Cohen, Juliet T Jarrell & Xudong Huang
June 1, 2018
Machine Learning-based Virtual Screening and Its Applications to Alzheimer’s Drug Discovery: A Review
Kristy A. Carpenter and Xudong Huang
May 9, 2018
Most Ligand-Based Benchmarks Measure Overfitting Rather than Accuracy
Izhar Wallach, Abraham Heifets
October 10, 2015
Atomnet: A deep convolutional neural network for bioactivity prediction in structure-based drug discovery
Izhar Wallach, Michael Dzamba, Abraham Heifets
May 5, 2014
Systems and methods for applying a convolutional network to spatial data
Abraham Heifets, Izhar Wallach, Michael Dzamba