A community-powered search of machine learning strategy space to find NMR property prediction models. - Lars A. Bratholm; Will Gerrard; Brandon M. Anderson; Shaojie Bai; Sunghwan Choi; Lam Dang; Pavel Hanchar; Addison Howard; Guillaume Huard; Sanghoon Kim; J. Zico Kolter; Risi Kondor; et al. (CoRR, 2020)

Improved Scaffold Hopping in Ligand-Based Virtual Screening Using Neural Representation Learning. - Luka Stojanovic; Milos Popovic; Nebojsa Tijanic; Goran Rakocevic; Marko Kalinic (J. Chem. Inf. Model., 2020)