Prediction of crystal structures of organic molecules is a critical task in many industries, especially in pharmaceuticals ...

Crystal structure prediction (CSP) of organic molecules is a critical task, especially in pharmaceuticals and materials ...

Spiroaspertrione A is a complex polycyclic compound naturally produced by the fungus Aspergillus sp. TJ23. First isolated in ...

Researchers from the University at Albany and NYU Grossman School of Medicine have found a way to block a key cellular ...

Researchers at Harvard Medical School developed a tool that uses artificial intelligence to accelerate drug discovery and development. The new technology, called PDGrapher, applies machine learning to ...

By combining mass spectrometry imaging with an automated analysis tool, researchers from Hebrew University have developed a ...

Proteins play a key role not only in the body, but also in medicine: they either serve as active ingredients, such as enzymes ...

The integration of artificial intelligence (AI) into drug discovery is revolutionizing pharmaceutical research by providing sophisticated tools for understanding and predicting complex biological ...

Drug company Eli Lilly and NVIDIA announced a new partnership to build a supercomputer for drug research. Drug manufacturer ...

Geneva -- The World Health Organization sounded the alarm Monday over soaring numbers of drug-resistant bacterial infections, compromising the effectiveness of life-saving treatments and rendering ...