Kavli Affiliate: Yi Zhou | First 5 Authors: Siyu Long, Yi Zhou, Xinyu Dai, Hao Zhou, | Summary: Drug design is a crucial step in the drug discovery cycle. Recently, various deep learning-based methods design drugs by generating novel molecules from scratch, avoiding traversing large-scale drug libraries. However, they depend on scarce experimental data or […]
Continue.. Zero-Shot 3D Drug Design by Sketching and Generating