Outwitting DNA’s photostability: novel photosensitizers based on natural nucleobases thiosubstituted derivatives
Inés Corral Pérez
Célia Fonseca-Guerra
Explaining Chemistry with repulsive Frontier Orbitals
Department of Theoretical Chemistry and Amsterdam Center for Multiscale Modeling
VU University Amsterdam
The Netherlands
Jeremy Harvey
Accurate computational modelling of the kinetics of homogeneous catalysis: Progress and Challenges
Chemistry Department
KU Leuven
Belgium
Robert Paton
Chiral ion-pairs: dissociation, dynamics and asymmetric catalysis
Chemistry Research Laboratory
University of Oxford
United Kingdom
Ursula Roethlisberger
Benedetta Mennucci
Modeling linear and nonlinear optical spectra of multichromophoric biosystems: a multiscale strategy
Dipartimento di Chimica e Chimica Industriale
Università de Pisa
Italy
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
Clémence Corminboeuf
An Old Principle Applied to Homogeneous Catalysis