3 papers
quant-ph2025
Quantum Simulation of Charge and Exciton Transfer in Multi-mode Models using Engineered Reservoirs
Visal So, Midhuna Duraisamy Suganthi, Mingjian Zhu +7
Quantum simulation offers a route to study open-system molecular dynamics in non-perturbative regimes by programming the interactions among electronic, vibrational, and environment…
q-bio.BM2025
The need to implement FAIR principles in biomolecular simulations
Rommie Amaro, Johan à qvist, Ivet Bahar +125
This letter illustrates the opinion of the molecular dynamics (MD) community on the need to adopt a new FAIR paradigm for the use of molecular simulations. It highlights the necess…
quant-ph2025
Trapped-Ion Quantum Simulation of Electron Transfer Models with Tunable Dissipation
Visal So, Midhuna Duraisamy Suganthi, Abhishek Menon +6
Electron transfer is at the heart of many fundamental physical, chemical, and biochemical processes essential for life. The exact simulation of these reactions is often hindered by…