Lindqvist -- a blog about Linux and Science. Mostly.: simple example

Lindqvist -- a blog about Linux and Science. Mostly.

Lindqvist - a blog about Linux and Science. Mostly.

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Showing posts with label simple example. Show all posts

Showing posts with label simple example. Show all posts

18 January 2012

53. GROMACS -- carbon dioxide in water. Example

I'm new to GROMACS, so don't follow what I've done blindly. To get started you need a .top and a .gro file. The .gro file is ...

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