Microsoft’s artificial intelligence tool BioEmu can predict the multiple conformational states of a protein, giving insight into how a protein moves and its potential function.

The graphite found in your favorite pencil could have instead been the diamond your mother always wears. What made the ...

Seabed-origin oil spills pose distinct challenges in marine pollution management due to their complex transport dynamics and ...

ORNL scientists confirmed critical errors in standard water simulations, emphasizing the need for accurate time steps to ...

The graphite found in your favorite pencil could have instead been the diamond your mother always wears. What made the ...

Molten carbon can crystallize into diamond or graphite, but it has been difficult to study this process. New simulations show ...

More than a year ago, computational scientists at the Department of Energy's Oak Ridge National Laboratory published a study ...

Water is the most prevalent component of biomolecular simulations - from protein ensembles to nucleic acids - and ...

Scientists have discovered novel drug candidates which could ultimately lead to new effective treatments for conditions ...

In situ polymerization in a covalent organic framework boosts lithium-ion conduction in solid polymer electrolytes, advancing ...

Researchers have created a molecule that can store magnetic data at record-high temperatures, potentially reshaping how ...

UB researcher Viviana Monje and colleagues have been awarded a $1.2 million grant to study how the popular aquarium fish ...