Innovation requires information, context, collaboration, experimentation, and even failure. Using simulation to make ...

CGSchNet, a fast machine-learned model, simulates proteins with high accuracy, enabling drug discovery and protein ...

PhoSim simulates the atmosphere, including air turbulence, as well as distortions from the shape of the telescope’s mirrors and the electrical properties of the sensors. The photons are propagated ...

Researchers present BioEmu – a new AI model that rapidly and accurately predicts the full range of shapes a protein can adopt, offering a faster, cheaper alternative to traditional molecular ...

Here we use cryogenic electron microscopy to determine the structure of TbAQP2 from Trypanosoma brucei, bound to either the substrate glycerol or to the sleeping sickness drugs, pentamidine or ...