Coronavirus disease 2019 (COVID-19) caused by the novel severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2) presents a significant threat to global public health. As of today, it has caused ...

Our goal is to improve student learning with our simulation of protein separation and analysis tools frequently used in chemistry, biochemistry, and proteomics research. JBioFramework (JBF) is a set ...

Molecular dynamics (MD) simulations offer a powerful computational approach to decipher the complex and transient nature of peptide-protein interactions. By calculating the time-dependent behaviour of ...

CGSchNet, a fast machine-learned model, simulates proteins with high accuracy, enabling drug discovery and protein engineering for cancer treatment. Operating significantly faster than traditional all ...

In a recent study published in Molecular Systems Biology, researchers demonstrated that advances in modeling protein-ligand interactions using machine learning-based approaches are needed to exploit ...

A major scientific advance in protein modeling developed by Microsoft Research AI for Science, has been published in Science. The study introduces BioEmu, a generative deep learning system that ...

HERSHEY, Pa. -- Parkinson's disease is the second most common neurodegenerative disease and affects more than 10 million people around the world. To better understand the origins of the disease, ...

Researchers have used computational models to understand what drives the accumulation of alpha-synuclein protein, a key culprit in the development of Parkinson’s disease. The study, published today as ...

To add a little context, it's probably worth noting that this is an advance in computation methodology, not necessarily in biochemistry or in drug discovery. Many scientists - especially discovery ...

Researchers discovered how the Lsr2 protein silences foreign DNA in tuberculosis bacteria. By forming protein condensates on ...

A research team has developed a next-generation anti-inflammatory protein using AI and supercomputing. Subscribe to our newsletter for the latest sci-tech news updates. The team, led by Professor ...