Address:
Institut für Theoretische Physik I
Universität Erlangen-Nürnberg
Staudtstraße 7
91058 Erlangen
Germany

How to find us

Phone: +49-9131-85 28442
Fax: +49-9131-85 28444

Department Physik
Teilbibliothek Physik Web-Opac
UnivIS FAU Erlangen-Nürnberg

Physikalisches Kolloquium
Kolloquium der Theor. Physik
Gruppenseminar der Theorie 1

Doktorarbeit

  • Karmen Condic-Jurkic
  • Strategies in the Computational Modelling of Biological Systems: Case Studies with Radical Enzymes
Abstract

Theoretical advances and the development of information technology over the last decades have combined to place computational approaches to molecular modelling at the forefront of scientific research. As such, modern molecular modelling can be considered to be a powerful tool in the investigations of various processes taking place at the atomic level - from simple chemical reactions to the association of large molecules into complex structures. As an example of the latter, biological systems represent a special challenge for modelling due to their complexity and the intricate liaisons between quantum events and the macroscopic behaviour of living systems. Chemical reactions, on the other hand, are the elementary steps of numerous cellular processes, in which enzymes, as biological catalysts, play a crucial role.