Platform>MIND-QM/MM Docking

MIND-QM/MM Docking

From The Mind Come Drugs of the Future


QM/MM Docking

  • 1

    Conventional docking based on MM methods is computationally inefficient to describe the quantum chemical in nature such as covalent interactions, polarization, and charge transfer.

  • 2

    Our QM/MM hybrid docking methods preserve the high accuracy of binding-affinity prediction between protein and small ligand.