Reposted by Lars
Check out my poster on 'Trajectory Level Langevin Dynamics' aka 'Simulations of simulations', using differentiable MD forcefields, at the 'ML and the Physical Sciences' Workshop @NeurIPS!
Link: openreview.net/pdf?id=daEra...
I am a PhD candidate at the Frankfurt Institute for Advanced Studies, working on simulation-based inference in biophysics.