Review GROMACS Wizard Light
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GROMACS Wizard Light

Publisher: OneAngstrom

Updated: November 06, 2019


Latest versions

Windows: 0.8.7 on SAMSON 0.8.5

Linux: 0.8.7 on SAMSON 0.8.5

Mac: 0.8.7 on SAMSON 0.8.5

Free element

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GROMACS Wizard Light

Publisher: OneAngstrom

Updated: November 06, 2019


Latest versions:

- Windows: 0.8.7 on SAMSON 0.8.5

- Linux: 0.8.7 on SAMSON 0.8.5

- Mac: 0.8.7 on SAMSON 0.8.5

Prepare and minimize systems using GROMACS. A free version of GROMACS Wizard.

This SAMSON Element allows you to easily use GROMACS and integrate its most powerful functionalities into your modeling and simulation workflow.

This element integrates version 5.1 of GROMACS.

Prepare models

Prepare simulations using the most popular force fields provided with GROMACS.

Prepare models

In a few clicks you can add solvent...

Add solvent

... and ions:

Add ions

Minimize

Perform energy minimization easily and automatically load the resulting trajectory...

Minimize

... and visualize plots all within SAMSON:

Show plots

And more

For more information about all features of this SAMSON Element, please refer to the GROMACS Wizard Light tutorial.

If you want to perform equilibration, production simulations, and access many more advanced features, check the GROMACS Wizard version.

Reference

GROMACS version 5.1

van der Spoel, et al. (2005) J. Comput. Chem. 26: 1701-1718.