A new and important discovery comes from the field of oncological research thanks to the joint work of researchers from the ...

In drug discovery, virtual screening is a fast and cost-effective way of narrowing down vast chemical libraries to identify the most promising hits, reducing synthesis and testing requirements while ...

Boosting virtual screening with machine learning allowed for a 10-fold time reduction in the processing of 1.56 billion drug-like molecules. Researchers from the University of Eastern Finland teamed ...

Chinese researchers have developed an artificial intelligence-powered virtual drug screening platform that achieves a millionfold increase in screening speeds and a significant improvement in ...

A cryo-EM and GPCR expert, a virtual screening pioneer, and a virtual chemical library creator walk into a bar. The result is not the opening line of a joke but rather the founding of a start-up that ...

Australian researchers, led by Monash University, have invented a new artificial intelligence (AI) tool which is poised to reshape virtual screening in early stage drug discovery and enhance ...

The process of identifying promising small molecule drug candidates that target cancer checkpoints may become faster and smarter through virtual screening, according to Weill Cornell Medicine ...

A research team from the University of Hong Kong has developed a general computational protocol for phosphorescent platinum(II) complexes via high throughput virtual screening and Δ-learning ...