Systems and methods for applying a convolutional network to spatial data – Atomwise

Systems and methods for applying a convolutional network to spatial data

Date
May 1, 2018

Tags

AI drug discovery
artificial intelligence
AtomNet® technology
drug discovery

Atomnet: A deep convolutional neural network for bioactivity prediction in structure-based drug discovery

Most Ligand-Based Benchmarks Measure Overfitting Rather than Accuracy