Biocatalytic intermediates for the discovery and design of new enzymatic activities

Chemical concepts from wavefunction analysis

Nonlinear Optical Properties and Theoretical Chemistry

ACCEMBLY: Accelerating (Bio)molecular Recognition, Assembly, and Catalysis

Transition Metals in Organic Synthesis

Excited States and Non-Adiabatic Processes

Unravelling the mechanisms behind O2 and N2O activation

Biologically inspired design of transition metal reactivity and catalysis

Molecular recognition and bioinspired catalysis with artificial receptors

Computational design of proficient enzymes: exploring the molecular basis of biocatalysis

Multicatalysis for the functionalization of organic substrates, water oxidation and CO2 fixation

Sustainable C-H functionalization catalysis and Supramolecular chemistry at the confined space of nanocapsules

Catalysis and Aromaticity

Spinning around in transition-metal chemistry
