Hybrid MM/CG Webserver
Automatic set up of Molecular Mechanics/Coarse-Grained (MM/CG) simulations for human G Protein-Coupled Receptor (GPCR)/ligand complexes.
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.
See the results or check the status of your simulations. Check out preliminary analysis data and download files to continue your simulations.
Detailed explaination of the hybrid MM/CG method. Individual steps of the preparation are explained.
To use the example Adenosine 2A receptor in complex with caffeine, just click through the pages, without modifying parameters or uploading files.
Computational Biomedicine (IAS-5 / INM-9)
Create a homology model of a GPCR based on the sequence and dock your ligand to prepare the input for this server.
57530 pageviews since June 2020