Simulations and experiments show that hydrogen bonds play an important role for the stability of peptide bonds against UV radiation. (more…)
Diverse mechanisms of formation and repair of CPDs with different charge, excitation, and multiplicity states are mapped using high-level ab initio methods. (more…)
Benchmark of excited-state nonadiabatic dynamics simulations for adenine shows the limits of quantum chemical methods. (more…)
Computational chemistry explains a photochemical reaction at the origin of life. (more…)
