Simulation of Molecular Interactions for Decontamination

Accurately modelling complex molecular interactions between enzymes/catalysts and pollutants like phenol for effective water decontamination is challenging and computationally intensive for classical computers.

Quantum computing offers a solution by using graph-based methods to represent interactions and quantum algorithms such as VQE and approaches like Boson Sampling to more efficiently model dynamics and binding energies.

This enables faster and more accurate predictions of effective decontamination methods, leading to the quicker development of sustainable solutions, reduced research expenses, and scalable technologies for tackling water pollution.