A new class of coumarin photocaging groups modified with an electron‐rich styryl moiety at
the 3‐position was constructed. The large π‐conjugated structure and stabilization of the …

Cepharanthine, a natural alkaloid obtained from the Stephania cepharantha Hayata plant,
that has antitumor, anti-inflammatory, antioxidative, antiparasitic, and antiviral properties …

When and how do external electric fields (EEFs) lead to catalysis in the presence of a (polar
or nonpolar) solvent? This is the question that is addressed here using a combination of …

Molecular dynamics simulations were performed using a modified amoeba force field to
determine hydration and dynamical properties of the divalent cations Ca 2+ and Mg 2+⁠ …

Now a days, more than 200 countries faces the health crisis due to epidemiological disease
COVID-19 caused by SARS-CoV-2 virus. It will cause a very high impact on world's …

This study investigates the rich mechanistic landscape of the iconic electrophilic aromatic
substitution (EAS) reaction class, in the gas phase, in solvents, and under stimulation by …

As human serum albumin (HSA) being the most abundant blood protein involved in the role
of transport of molecules (drugs), we have designed HSA binding organic charge transfer …

Recent experiments have reported modified chemical reactivity under vibrational strong
coupling (VSC) in microfluidic Fabry–Pérot cavities. In particular, the reaction rate of …

The present work outlines a general methodology for designing efficient catalytic
machineries that can easily be tweaked to meet the demands of the target reactions. This …

We have performed a database survey and a structural and computational study of the
potential and the limitations of halogenopyridinium cations as halogen bond donors. The …