Newton-X platform for dynamics and ensembles
Excited-state dynamics with machine learning
Ultrafast internal conversion without energy crossing
Surface hopping with polarizable force fields
H-bond’s role in adenosine’s photophysics
Correcting ZPE leakage in dynamics
Ultrafast internal conversion at large energy gaps
Is Boltzmann’s S = k log W right?
Heating and cooling a chromophore after photoexcitation
Simulations of molecular photodynamics in long timescales
