Lab for Computational Life Sciences
Web Applications
MDSimAid Recommender
If you have your PDB, PSF, and parameter (PAR,INP,etc.) files and are ready to start
a simulation, first have MDSimAid create configuration files with optimized parameters.
Thank you for your interest in MDSimAid. For email updates on new features and availability please send your email address to us at MDSimAid Team
Protein-Protein Interaction
If you wish to determine potential interactions of proteins, you can visit the
PPI portal. All you need is a
protein structure database of your choosing, and a training and testing set. Or, you
can run a simulation with sample data provided by the portal.
