Janet, Jon Paul
- SemlaFlow -- Efficient 3D Molecular Generation with Latent Attention and Equivariant Flow Matching
2024/06/11 by Ross W. Irwin, Ross Irwin, Irwin, Ross +7 · 2 voices · 8 citations
Computer Science · Engineering · #Artificial Intelligence (cs.AI) #FOS: Computer and information sciences #Innovative Microfluidic and Catalytic Techniques Innovation #Machine Learning (cs.LG) #Microfluidic and Capillary Electrophoresis Applications #Nanopore and Nanochannel Transport Studies #Neural and Evolutionary Computing (cs.NE) #cs.AI #cs.LG #cs.NE
- An end-to-end attention-based approach for learning on graphs
2024/02/16 by Buterez, David, Janet, Jon Paul, Oglic, Dino +1 · 4 citations
#Artificial Intelligence (cs.AI) #FOS: Computer and information sciences #Machine Learning (cs.LG)
- Graph Neural Networks with Adaptive Readouts
2022/11/09 by David Buterez, Buterez, David, Jon Paul Janet +7 · 3 citations
Computer Science · Materials Science · #Advanced Graph Neural Networks #Artificial Intelligence (cs.AI) #Computational Drug Discovery Methods #FOS: Computer and information sciences #Machine Learning (cs.LG) #Machine Learning in Materials Science
- FLOWR: Flow Matching for Structure-Aware De Novo, Interaction- and Fragment-Based Ligand Generation
2025/04/14 by Cremer, Julian, Irwin, Ross, Tibo, Alessandro +3 · 10 citations
#Biomolecules (q-bio.BM) #FOS: Biological sciences #FOS: Computer and information sciences #Machine Learning (cs.LG) #Quantitative Methods (q-bio.QM)
- PepINVENT: Generative peptide design beyond the natural amino acids
2024/09/21 by Geylan, Gökçe, Janet, Jon Paul, Tibo, Alessandro +7 · 3 citations
#Artificial Intelligence (cs.AI) #Biomolecules (q-bio.BM) #FOS: Biological sciences #FOS: Computer and information sciences