Hybrid MM/CG preparation

Begin the setup of your hybrid MM/CG simulation for GPCRs using the fully automatic method with default parameters or the interactive method showing intermediate results.

Results

See the results or check the status of your simulations. Check out preliminary analysis data and download files to continue your simulations.

Documentation

Detailed explaination of the hybrid MM/CG method. Individual steps of the preparation are explained.

Example

To use the example Adenosine 2A receptor in complex with caffeine, just click through the pages, without modifying parameters or uploading files.

Contact

Forschungszentrum Jülich
Computational Biomedicine (IAS-5 / INM-9)

GOMoDo

Create a homology model of a GPCR based on the sequence and dock your ligand to prepare the input for this server.