One of the simplest, most over-studied organisms in the world is the C. elegans nematode. For 13 years, a project called ...

Karpuzcu said the beauty of the direct simulation Monte Carlo is that it tracks each air molecule in the flow and captures the shocks. "When you use other methods to calculate fluid dynamics ...

Before running a quantum chemistry program for a molecule in solution it's necessary ... surrounding solvent molecules through molecular simulation. The process of setting up and running these ...

it's necessary to determine the geometry of the solute molecule and the location and orientation of the surrounding solvent molecules through molecular simulation. The process of setting up and ...

Advanced computational software is streamlining quantum chemistry research by automating many of the processes of running molecular simulations. The complicated design of these software packages, ...

Karpuzcu said the beauty of the direct simulation Monte Carlo is that it tracks each air molecule in the flow and captures the shocks. "When you use other methods to calculate fluid dynamics ...

As the clouds clear on computational crystal structure prediction, is the technique ready to empower mainstream materials ...

Researchers from the University of New Mexico found that gadolinium – a toxic rare earth metal used in MRI scans – could mix with oxalic acid found in many foods to precipitate tiny nanoparticles of ...

A new company has entered the drug discovery space with what it calls a “chemistry-first” platform. Colorado-based Cime Therapeutics has emerged from stealth with $2.1 million in preseed financing to ...