It is well-known that the solvent can strongly influence the course, rate, and equilibrium
position of many chemical reactions. 1, 2 The position and intensity of the bands in the …

The 0–0 energies of 80 medium and large molecules have been computed with a large
panel of theoretical formalisms. We have used an approach computationally tractable for …

With the aim of completing our previous efforts devoted to local and Rydberg transitions in
organic compounds, we provide a series of highly accurate vertical transition energies for …

Bipolar redox activity is generally obtained using a single moiety that can be both oxidized
and reduced or by tethering two distinct redox active molecules, together with a covalent …

The effects of five types of oxygen-containing functional groups (–COOH,–COC–,–OH,–
CHO, and–OCH3) on graphene quantum dots (GQDs) are investigated using time …

The effects of four heteroatoms (B, N, P, and S) with three doping patterns on graphene
quantum dots (GQDs) are systematically investigated using time-dependent density …

The past two decades witnessed the development of a new type of solvent system, named
deep eutectic solvents, which have become increasingly investigated because they offer …

The solvatochromicity of established solvatochromic UV/Vis probes, which appear to be
sensitive to the so‐called hydrogen bond donor (HBD) property of the solvent, is analysed …

A critical factor in achieving tunability in DESs is varying the type of hydrogen bond
acceptors (HBAs) and donors (HBDs). Choline halides (ChX), such as ChCl and ChBr, have …

The protective effects of the peptides Asp-Asp-Asp-Tyr (DDDY) and Asp-Tyr-Asp-Asp
(DYDD) against AAPH-induced HepG2 cells are unclear. Our objective was to investigate …