Chemistry PW-SMD: A Plane-Wave Implicit Solvation Model Based on Electron Density for Surface Chemistry and Crystalline Systems in Aqueous Solution. July 18, 2024
Chemistry | Toxicology Classification of substances by health hazard using deep neural networks and molecular electron densities. April 16, 2024
Biochemistry | Biophysics | Computational Chemistry Exploring protein-ligand binding affinity prediction with electron density-based geometric deep learning. February 5, 2024
Chemistry | Materials Science | Physics Correcting systematic errors in diffraction data with modern scaling algorithms. August 16, 2023
Biochemistry | Biophysics A unifying Bayesian framework for merging X-ray diffraction data. December 15, 2022
Medical Physics | Radiation Oncology | Radiology Improved accuracy of relative electron density and proton stopping power ratio through CycleGAN machine learning. April 13, 2022
Radiology A feasibility analysis on simultaneous electron density and attenuation coefficient reconstruction. September 26, 2021