Benedetta Mennucci
Modeling linear and nonlinear optical spectra of multichromophoric biosystems: a multiscale strategy
Dipartimento di Chimica e Chimica Industriale
Università de Pisa
Italy
Célia Fonseca-Guerra
Explaining Chemistry with repulsive Frontier Orbitals
Department of Theoretical Chemistry and Amsterdam Center for Multiscale Modeling
VU University Amsterdam
The Netherlands
Clémence Corminboeuf
An Old Principle Applied to Homogeneous Catalysis
Ecole Polytechnique Fédérale de Lausanne (EPFL)
Lausanne
Switzerland
Feliu Maseras
Microkinetic models can be an important complement to DFT calculations
Institute of Chemical Research of Catalonia (ICIQ)
Tarragona
Spain
Inés Corral Pérez
Outwitting DNA’s photostability: novel photosensitizers based on natural nucleobases thiosubstituted derivatives
Departamento de Química
Universidad Autónoma de Madrid
SPAIN
Jeremy Harvey
Accurate computational modelling of the kinetics of homogeneous catalysis: Progress and Challenges
Chemistry Department
KU Leuven
Belgium
Pedro A. Fernandes
Advances and Pitfalls on the Study of Enzymatic Reaction Mechanisms using QM/MM Methods
Department of Chemistry and Biochemistry
University of Porto
Portugal
Robert Paton
Chiral ion-pairs: dissociation, dynamics and asymmetric catalysis
Chemistry Research Laboratory
University of Oxford
United Kingdom
Walter Thiel
Quantum Chemistry: Status and Perspectives