The intuitive and highly visual GUI makes Surflex-Dock more easily accessible to computational and medicinal chemists modelling protein-ligand interactions. Surflex-Dock is a highly automated ...

Researchers led by Truong Son Hy, Ph.D., from the University of Alabama at Birmingham, offer a simplified method they call ...

Killer whales, as apex predators with long lifespans, are prone to accumulating high levels of persistent organic pollutants ...

SMILES, or the Simplified Molecular Input Line Entry ... "A key feature of our method is blind docking, which predicts how the redesigned protein interacts with its ligand without the need for ...

High levels of fat mass and obesity-associated protein (FTO) have been linked to increased tumor growth and resistance to ...

An elaborate scaffold of proteins coordinates this vesicle docking, and scientists long assumed these proteins were essential to neuron signaling. For years, Harvard Medical School neuroscientist ...

The study explores the potential of chitosan derivatives as novel inhibitors against the wild-type and emerging variants of ...