Neo-1 is the first model to unify de novo molecular generation and atomic-level structure prediction in a single model, by generating latent representations of whole molecules instead of predicting ...

You probably learned in high school chemistry class that core electrons don't participate in chemical bonding.

Apple developed an alternative AI model to predict the 3D structure of proteins, and it shows promise. Here are the details.

New computer simulations that model every atom of a protein as it folds into its final three-dimensional form support the existence of a recently identified type of protein misfolding. Proteins must ...

The study, led by Xiaochen Jin, used machine learning to determine that the atomic structure of Group 4 alloys, which ...

Try these interactive flashcards based on GCSE chemistry past papers. By working your way through the flashcards created by experts, you can prepare for your chemistry exams and make your revision ...