SPaDe-CSP first predicts most probable space groups and crystal densities using machine learning and then employs an efficient neural network potential for structure refinement. Prediction of crystal ...

Researchers from the National University of Singapore (NUS) have developed a boron-catalyzed method to transform oxetanes, ...

Posts from this topic will be added to your daily email digest and your homepage feed. AlphaFold 3 uses the same method as AI image generators to predict how different molecules fit together.

This hands-on course teaches step-by-step techniques for interpreting mass spectrometric data to identify molecular structures. Participants will learn elemental composition analysis, tandem MS ...

Scientists have created a computer program that 'paints' the structure of molecules in the style of famous Dutch artist, Piet Mondrian. Researchers are opening eyes and minds to the beauty of ...

Last week, Google released a much-anticipated upgrade for its AlphaFold software, which harnesses artificial intelligence to predict the shape and structure of molecules within the human body. Any ...

A team of chemists have developed a novel concept in which a mixture of molecules that behave like mirror images is converted to a single form. To this end, they use light as external energy source.

Google DeepMind CEO Demis Hassabis talked up AlphaFold 3 during Google I/O. This AI model uses generative AI capabilities to model how molecules of DNA, RNA, and proteins would look with a prompt from ...

Clathrate hydrates are crystalline structures formed at the bottom of seafloors, created by water molecules trapping methane, carbon dioxide or other molecules. While these materials are underutilized ...