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Learning Gromacs

Page last updated on: 2019-10-21

Gromacs manual

Gromacs is a Molecular Dynamics simulation package that involves significant physics, math, and computer science. The manual is quite comprehensive in covering all these topics. So start with reading reference manual corresponding to your version of Gromacs.

Learning Gromacs by examples

You can also learn from examples provided by Professor Lemkul:

Last update: 2019-10-21