Molecular machine learning (ML) underpins critical workflows in drug discovery, material science, and catalyst optimization ...

To address this relationship between structure and function ... 1 The disposition of the different atoms within the molecule and their connectivity determine the location of chemical groups able to ...

Fast-scanning atomic force microscopy imaging of the molecule at two different time points shows positional shifts along the polymer chain on the left. On the right, the molecular structure of PEG ...

Benzene's structure can be clearly understood through its molecular arrangement. A benzene molecule is composed of six carbon atoms arranged in a hexagonal ring, with each carbon atom bonded to ...