A core insight that can be obtained from such models is the so-called detailed reaction mechanism. This is the dominant path along which the reaction proceeds through the reaction network, that is, ...

Automated reaction prediction has the potential to elucidate complex reaction networks for applications ranging from combustion to materials degradation, but computational cost and inconsistent ...

(Nanowerk News) Self-assembled molecules are responsible for important cellular processes. Self-assembled structures such as microtubules or actin filaments are key to cell motility: change of shape, ...

Traditionally, chemical reactions have been described as one-line "equations" in which substrates, say A and B, convert purposefully but rigidly into a desired product, say C. Naturally, it has been ...

The ability to respond to changing surroundings was once considered exclusive to complex living organisms. Then came computers, specially designed for stimulus–response tasks, which can take in ...

Network control theory can describe the photochemical isomerization of glucose to allose. This transformation, in which the hydroxy group on a single carbon flips from one stereochemical configuration ...