Kearnes, Steven

1. Tensor field networks: Rotation- and translation-equivariant neural networks for 3D point clouds
   2018/02/22 by Nathaniel Thomas, Tess Smidt, Thomas, Nathaniel +11 · 2 voices · 169 citations
   Engineering · Computer Science · #cs.LG #cs.AI #cs.CV #cs.NE
2. Massively Multitask Networks for Drug Discovery
   2015/02/06 by Bharath Ramsundar, Steven Kearnes, Ramsundar, Bharath +12 · 16 citations
   Biochemistry, Genetics and Molecular Biology · Computer Science · Materials Science · Mathematics · #Cell Image Analysis Techniques #Computational Drug Discovery Methods #FOS: Computer and information sciences #Machine Learning (cs.LG) #Machine Learning (stat.ML) #Machine Learning in Materials Science #Neural and Evolutionary Computing (cs.NE) #cs.LG #cs.NE #stat.ML
3. Energy-based View of Retrosynthesis
   2020/07/14 by Ruoxi Sun, Hanjun Dai, Sun, Ruoxi +7 · 2 citations
   Biochemistry, Genetics and Molecular Biology · Computer Science · Materials Science · #Chemical Physics (physics.chem-ph) #Computational Drug Discovery Methods #FOS: Biological sciences #FOS: Computer and information sciences #FOS: Physical sciences #Machine Learning (cs.LG) #Machine Learning in Materials Science #Protein Structure and Dynamics #Quantitative Methods (q-bio.QM)
4. Decoding Molecular Graph Embeddings with Reinforcement Learning
   2019/04/18 by Steven Kearnes, Li Li, Kearnes, Steven +3 · 2 citations
   Biochemistry, Genetics and Molecular Biology · Computer Science · Materials Science · #Computational Drug Discovery Methods #FOS: Computer and information sciences #Machine Learning (cs.LG) #Machine Learning (stat.ML) #Machine Learning in Materials Science #Protein Structure and Dynamics
5. Modeling Industrial ADMET Data with Multitask Networks
   2016/06/28 by Steven Kearnes, Brian Goldman, Kearnes, Steven +3 · 2 citations
   Computer Science · Engineering · Materials Science · #Computational Drug Discovery Methods #FOS: Computer and information sciences #Innovative Microfluidic and Catalytic Techniques Innovation #Machine Learning (stat.ML) #Machine Learning in Materials Science