20115901
Vorlesung
SoSe 18: Methods of Molecular Simulations
Petra Imhof
Kommentar
This course teaches molecular simulation algorithms and techniques, in particular:
- Optimisation of stationary points on the potential energy surface
- Normal mode analysis
- Computation of Minimum energy pathways -Implicit Solvent Methods
- Electrostatic treatment
- Molecular dynamics algorithm and integrators
- Monte Carlo sampling
- Thermostats and Barostats
Description:
Exercises will be computer based
13 Termine
Regelmäßige Termine der Lehrveranstaltung
Do, 19.04.2018 16:00 - 18:00
Do, 26.04.2018 16:00 - 18:00
Do, 03.05.2018 16:00 - 18:00
Do, 17.05.2018 16:00 - 18:00
Do, 24.05.2018 16:00 - 18:00
Do, 31.05.2018 16:00 - 18:00
Do, 07.06.2018 16:00 - 18:00
Do, 14.06.2018 16:00 - 18:00
Do, 21.06.2018 16:00 - 18:00
Do, 28.06.2018 16:00 - 18:00
Do, 05.07.2018 16:00 - 18:00
Do, 12.07.2018 16:00 - 18:00
Do, 19.07.2018 16:00 - 18:00