The process of discovering molecules that have the properties needed to create new medicines and materials is cumbersome and ...

Kimberly Hansen, collections manager of flowering plants, wears gloves to protect her hands as she shows off deadly pong pong ...

Advanced computational software is streamlining quantum chemistry research by automating many of the processes of running ...

In the default model, the graph representing each individual enhancer can be arbitrarily complicated. To show how the ABC Score formula can arise from the default model, we need to impose the further ...

But one aspect – the texture of the metals used – has been historically overlooked.

A multitask graph neural network is developed with mechanism-informed reaction graphs for site-selectivity prediction of ruthenium-catalysed C‒H functionalization of arenes. The extrapolative ...

The new observations from a team with Professors Tobin Marks and Michael Bedzyk could lead to more efficient catalysts for ...

Materials science is an interdisciplinary field concerned with the understanding and application of the properties of matter. Materials scientists study the connections between the underlying ...