Mahmood, Omar
- 3D molecule generation by denoising voxel grids
2023/06/13 by Pedro O. Pinheiro, Joshua A. Rackers, Pinheiro, Pedro O. +15 · 8 citations
Biochemistry, Genetics and Molecular Biology · Materials Science · #Cell Image Analysis Techniques #FOS: Biological sciences #FOS: Computer and information sciences #Machine Learning (cs.LG) #Machine Learning in Materials Science #Protein Structure and Dynamics #Quantitative Methods (q-bio.QM)
- Structure-based drug design by denoising voxel grids
2024/05/07 by Pedro O. Pinheiro, Pinheiro, Pedro O., Arian R. Jamasb +7 · 8 citations
Biochemistry, Genetics and Molecular Biology · #Biomolecules (q-bio.BM) #Cell Image Analysis Techniques #FOS: Biological sciences #FOS: Computer and information sciences #Machine Learning (cs.LG)
- NEBULA: Neural Empirical Bayes Under Latent Representations for Efficient and Controllable Design of Molecular Libraries
2024/07/03 by Ewa M. Nowara, Pedro O. Pinheiro, Nowara, Ewa M. +11 · 2 citations
Computer Science · Materials Science · #Biomolecules (q-bio.BM) #Computational Drug Discovery Methods #FOS: Biological sciences #FOS: Computer and information sciences #Machine Learning (cs.LG) #Machine Learning in Materials Science