Скачать
Molecular Dynamics - chapter 3: Periodic Boundary Conditions, Temperature and Pressure
Автор: MoBioChem
Загружено: 2020-05-06
Просмотров: 18735
Описание:
We explain how periodic boundary conditions are applied to molecular dynamics simulations in order to mimic the behaviour of macroscopic systems. We pay special attention to the computation of the long-range electrostatic interactions by introducing the Ewald summation method in a simple way. Thermostats and barostats aimed to control the temperature and pressure are shortly described.
Доступные форматы для скачивания:
Скачать видео mp4
-
Информация по загрузке:
