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cs.LG2024
Variational Flow Matching for Graph Generation
Floor Eijkelboom, Grigory Bartosh, Christian Andersson Naesseth +2
We present a formulation of flow matching as variational inference, which we refer to as variational flow matching (VFM). Based on this formulation we develop CatFlow, a flow match…
cond-mat.soft2024★ 18 cited
Learning Neural Free-Energy Functionals with Pair-Correlation Matching
Jacobus Dijkman, Marjolein Dijkstra, René van Roij +3
The intrinsic Helmholtz free-energy functional, the centerpiece of classical density functional theory, is at best only known approximately for 3D systems. Here we introduce a meth…