Open access
Jul 2026
Quantum Computing Calculations of Protein–Ligand Binding Energies Using Decomposition Methods on Simulated and Real Quantum Hardware
The results demonstrated that the use of quantum algorithms can enhance the binding energy correlation value, offering potential applications in the workflow of computer-aided drug design.
Hironobu Kitajima, Carlos Bistafa, Takao Kobayashi et al.
· Journal of Chemical Informat... · 0 citations