Introduction to molecular modelling

Education facts

Code: KEM552

Today, computer simulations for molecules and systems of molecules often complement or replace experimental investigations and become an integral part of the chemist's "tool box". The course describes, from theta user's perspective, the computational modeling of both small and large systems, such as proteins, DNA, or ligand-receptor complexes, under real conditions (aqueous solution, finite temperatures) with the help of molecular mechanics combined with molecular dynamics and Monte-Carlo methods. Applications e.g. in drug design are discussed. The methods and concepts are illustrated by extensive computer exercises.

Entry requirements

90 credits within Science (or 120 credits within pharmacy/medicine). These courses should include KEM040 (physical chemistry 15 credits) or FYP203 (quantum physics 7.5 credits). Students with equal qualifications can be admitted. Mathematics 15 credits is strongly recommended.

Education offerings

Each offering has its own dates and conditions. Closed offerings are retained as history and do not mean that a new application is open.

• Introduction to molecular modelling

  University of Gothenburg

  Start date: 11 December 2025

  End date: 18 January 2026

  Pace of study: 75 %