Virtual screening methods fall broadly into two categories: ligand- and structure-based. Ligand-based virtual screening doesn’t require a target protein structure, Instead, it leverages known active ...

A quick, purification-free method was developed by researchers at the Institute of Science Tokyo, to capture the detailed 3D ...

Prediction of crystal structures of organic molecules is a critical task in many industries, especially in pharmaceuticals ...

Crystal structure prediction (CSP) of organic molecules is a critical task, especially in pharmaceuticals and materials ...

Abstract: Integral equation methods are extensively used for computational electromagnetism, and can be applied to large problems when accelerated with fast multipole or fast Fourier transform (FFT) ...

How OpenRewrite uses Lossless Semantic Trees to deliver a full-fidelity representation of code, making transformations precise, repeatable, and auditable.

Abstract: One hot-researched application of multi-robot systems is cooperative object transport, a task in which multiple robots collaboratively move an object that is too larger, bulky or heavy for a ...

UPDATE AS OF 10:39 A.M.: The structure fire has been contained and Smith Hill Way is back open. A structure fire has caused Smith Hill Way to close at Colorado Highway 82 as of 8:50 a.m. Drivers are ...

Not-so-fun fact: our oceans hold 150 times more carbon dioxide than the Earth's atmosphere. Adding to that causes ocean acidification, which can disrupt marine food chains and reduce biodiversity.